Chemical Compound

DTXSID60859798

CAS Registry Number 81017-52-9
DTXSID60859798 chemical structure
Primary Record

DTXSID60859798

In stock
5,688 g
Purity
98.9 %
CAS
81017-52-9

Compound Identifiers & Properties

CAS
81017-52-9
PubChem CID
165367687
SMILES
CC1=C/C(=C(\C2=CC(=C(C=C2)N)S(=O)(=O)O)/C3=CC(=C(C=C3)N)S(=O)(=O)[O-])/C=C(C1=N)S(=O)(=O)[O-].[Na+].[Na+].Cl
Canonical SMILES
CC1=C/C(=C(/c2ccc(N)c(S(=O)(=O)[O-])c2)c2ccc(N)c(S(=O)(=O)O)c2)C=C(S(=O)(=O)[O-])C1=N.Cl.[Na+].[Na+]

Names & Synonyms

  • DTXSID60859798
  • 81017-52-9
  • Sodium 2-amino-5-((4-amino-3-sulfonatophenyl)(4-imino-3-sulfocyclohexa-2,5-dien-1-ylidene)methyl)-3-methylbenzenesulfonate hydrochloride (2:1:1)
  • Sodium 2-amino-5-[(4-amino-3-sulfonatophenyl)(4-imino-3-sulfocyclohexa-2,5-dien-1-ylidene)methyl]-3-methylbenzene-1-sulfonate--hydrogen chloride (2/1/1)