Sodium 4-[(4-methyl-3-nitrobenzoyl)amino]benzenesulfonate

Benzenesulfonic acid, 4-[(4-methyl-3-nitrobenzoyl)amino]-, monosodium salt
Benzenesulfonic acid, 4-[(4-methyl-3-nitrobenzoyl)amino]-, sodium salt (1:1)

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PISGJNQDZMXKAX-UHFFFAOYSA-N, YLDIMJOASVRWAO-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string	InChI=1S/C14H12N2O6S.Na/c1-9-2-3-10(8-13(9)16(18)19)14(17)15-11-4-6-12(7-5-11)23(20,21)22;/h2-8H,1H3,(H,15,17)(H,20,21,22);/q;+1/p-1
IUPAC name chemrof:IUPAC_name	Sodium 4-[(4-methyl-3-nitrobenzoyl)amino]benzenesulfonate
Molecular formula chemrof:molecular_formula	C14H11N2NaO6S, C14H12N2NaO6S
SMILES string chemrof:smiles_string	Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)[O-])cc2)cc1[N+](=O)[O-].[Na+]

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=84029-45-8	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/131885746	enrich_references.pubchem_compound

Flow	Context	Source	Unit	CFs
27306250-69da-45f5-8c53-1cfb13464372	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
a14e372d-d7f9-4983-bd3f-89652c98ee2b	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
05cda2f9-073c-4b46-88e0-f05d6b947ea6	Environmental → Air → Indoor	EF 3.1	kg	2
784ef3ae-2451-4430-a8de-f77d830435f2	Environmental → Air → Long-term	EF 3.1	kg	0
66398a7a-dca2-4cd6-8627-2309bae49c6f	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
b880d9fc-2655-47a5-af5c-4df0d868fcf6	Environmental → Air → Unknown	EF 3.1	kg	2
79ecdc1c-49ce-4010-a09b-86353dc3112f	Environmental → Ground → Agricultural	EF 3.1	kg	2
750ec3f7-6dfd-4fc7-bde3-6c07f3df249a	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
3a7f64a9-5e95-4f81-a3a1-626014624f2c	Environmental → Ground → Unknown	EF 3.1	kg	2
fbe4fa85-c00f-499c-a5f9-fd4f27821b9f	Environmental → Water → Long-term	EF 3.1	kg	0
109624f8-de1e-427f-9f11-8f55d83892d7	Environmental → Water → Ocean	EF 3.1	kg	2
bfba6bb7-47aa-4590-88ee-a5e10808df07	Environmental → Water → Surface water	EF 3.1	kg	2
e7c01c7d-d6f8-4de0-93c6-5c414fb23bb8	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

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Flow object JSON

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Sodium 4-[(4-methyl-3-nitrobenzoyl)amino]benzenesulfonate

Identity

Structure

Alternative labels

Properties

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Elementary flows

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