Sodium 1-amino-4-[2-methyl-5-(4-methylphenylsulfonylamino)phenylamino]anthraquinone-2-sulfonate

2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[2-methyl-5-[[(4-methylphenyl)sulfonyl]amino]phenyl]amino]-9,10-dioxo-, monosodium salt
2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[2-methyl-5-[[(4-methylphenyl)sulfonyl]amino]phenyl]amino]-9,10-dioxo-, sodium salt (1:1)

Property	Value
InChI2D key string chemrof:inchi2d_key_string	HUVRATWEFXEASA-UHFFFAOYSA-M, SVQQEFBGCCFFHP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C28H23N3O7S2.Na/c1-15-7-11-18(12-8-15)39(34,35)31-17-10-9-16(2)21(13-17)30-22-14-23(40(36,37)38)26(29)25-24(22)27(32)19-5-3-4-6-20(19)28(25)33;/h3-14,30-31H,29H2,1-2H3,(H,36,37,38);/q;+1/p-1
IUPAC name chemrof:IUPAC_name	Sodium 1-amino-4-[2-methyl-5-(4-methylphenylsulfonylamino)phenylamino]anthraquinone-2-sulfonate
Molecular formula chemrof:molecular_formula	C28H22N3NaO7S2, C28H23N3NaO7S2
SMILES string chemrof:smiles_string	Cc1ccc(S(=O)(=O)Nc2ccc(C)c(Nc3cc(S(=O)(=O)[O-])c(N)c4c3C(=O)c3ccccc3C4=O)c2)cc1.[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=84057-97-6	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/131885758	enrich_references.pubchem_compound

Flow	Context	Source	Unit	CFs
c92d247d-c2ab-49ef-b311-89379b3fe8db	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
62c599d6-b34b-4fa9-aa31-46c358b23af2	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
4df3f45a-3864-4b5a-9acd-d55bdbcbd46d	Environmental → Air → Indoor	EF 3.1	kg	2
f099c08b-6b15-45ac-a8fe-bd6409c3aead	Environmental → Air → Long-term	EF 3.1	kg	0
cb61c1a6-4c16-4920-bc44-e16aeb3e3799	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
8748f6f4-bbef-4a21-81eb-82cae8230228	Environmental → Air → Unknown	EF 3.1	kg	2
7373da04-3ff5-4291-a924-d6c6830dac10	Environmental → Ground → Agricultural	EF 3.1	kg	2
adf47f50-726b-4900-8ff6-f897787a65ff	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
65d21536-1d61-4930-8b1a-0e5964e7323b	Environmental → Ground → Unknown	EF 3.1	kg	2
3cf9430b-098b-48bf-a299-9da15f8f865c	Environmental → Water → Long-term	EF 3.1	kg	0
ed1717e8-1c33-4e68-9277-686dc28f217a	Environmental → Water → Ocean	EF 3.1	kg	2
9da2431d-4cb3-46cd-8417-c44177013c4f	Environmental → Water → Surface water	EF 3.1	kg	2
11ca4bae-edf8-46c5-85c6-e291fccf7164	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

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Sodium 1-amino-4-[2-methyl-5-(4-methylphenylsulfonylamino)phenylamino]anthraquinone-2-sulfonate

Identity

Structure

Alternative labels

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Known URLs

Elementary flows

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