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N-(4-acetamidophenyl)-3-hydroxy-2-naphthamide

fo-ae4f66bd36b6e7a6

Identity

Type
Neutral molecule
CAS
41506-62-1
EC
255-419-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N-(4-acetamidophenyl)-3-hydroxy-2-naphthamide

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string MSRUOXBBGPWHEG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C19H16N2O3/c1-12(22)20-15-6-8-16(9-7-15)21-19(24)17-10-13-4-2-3-5-14(13)11-18(17)23/h2-11,23H,1H3,(H,20,22)(H,21,24)
IUPAC name chemrof:IUPAC_name N-(4-acetamidophenyl)-3-hydroxy-2-naphthamide
Molecular formula chemrof:molecular_formula C19H16N2O3
Molecular mass chemrof:molecular_mass 320.348
Monoisotopic mass chemrof:monoisotopic_mass 320.116092
SMILES string chemrof:smiles_string CC(=O)Nc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1

Known URLs

7

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=41506-62-1 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.050.364 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4068323 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2Z9GG6AL4B enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J320.093K enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/170529 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q72434673 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
0c38558f-53b6-43af-ada4-83997abf5617 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
81955d7f-09fe-4a3f-992a-eff61076a304 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
f7b2b5eb-d59d-40e1-8eb6-6b6f06c481b1 Environmental → Air → Indoor EF 3.1 kg 2
95c96a94-c347-401a-b240-446be5b9d0a0 Environmental → Air → Long-term EF 3.1 kg 0
886c4200-0509-4129-a43a-13686fc28da6 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
826f89c8-aac9-49b2-a1a4-e3b0620f897d Environmental → Air → Unknown EF 3.1 kg 2
b684bf9c-a4f1-4f68-ac52-0657dc6feafd Environmental → Ground → Agricultural EF 3.1 kg 2
8c895419-3500-4559-80f9-31cdb00b5551 Environmental → Ground → Non-agricultural EF 3.1 kg 2
12ffe47a-fdeb-46fe-b2c7-d9fee4360c2a Environmental → Ground → Unknown EF 3.1 kg 2
bf1009d5-f7d1-4adb-8c4d-479b64f9f688 Environmental → Water → Long-term EF 3.1 kg 0
3945980a-93e9-47b8-9c0d-b04aff361178 Environmental → Water → Ocean EF 3.1 kg 2
9ef682ec-aa57-42b9-a83e-7942f56dae31 Environmental → Water → Surface water EF 3.1 kg 2
bc77a6a6-42b5-41b3-8656-99a738d3b1e7 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-ae4f66bd36b6e7a6",
  "prefLabel": [
    {
      "@value": "N-(4-acetamidophenyl)-3-hydroxy-2-naphthamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Hydroxy-3-naphthoylamino-4′-acetylaminobenzene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=41506-62-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Naphthalenecarboxamide, N-[4-(acetylamino)phenyl]-3-hydroxy-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=41506-62-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N-[4-(Acetylamino)phenyl]-3-hydroxy-2-naphthalenecarboxamide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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      "@value": [
        "C19H16N2O3"
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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    },
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      ],
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      ],
      "attested_by": {
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        ]
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
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      ],
      "provenance": {
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      "attested_by": {
        "N-(4-acetamidophenyl)-3-hydroxy-2-naphthamide": [
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      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
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      ],
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        },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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      "rdfs:label": "Monoisotopic mass",
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      ],
      "provenance": [
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          ]
        }
      ],
      "attested_by": {
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        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
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    },
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    {
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    },
    {
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  ],
  "created_from": {
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    "seed_uuid": "0c38558f-53b6-43af-ada4-83997abf5617",
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      "types": [
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      ],
      "provenance": {
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  },
  "classifications": {
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      "rdfs:seeAlso": [
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  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
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  ]
}

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