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Substance Name: Acid Blue 7 free acid
RN: 1039452-58-8
UNII: 9B04W34BBD
InChIKey: VUXVWHOCQSLYRN-UHFFFAOYSA-O

Molecular Formula

  • C37-H37-N2-O6-S2

Molecular Weight

  • 669.8393
 
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Names and Synonyms

Name of Substance

  • Acid Blue 7 free acid

Synonyms

  • Acid Blue 7 free acid
  • Benzenemethanaminium, N-(4-((2,4-disulfophenyl)(4-(ethyl(phenylmethyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-
  • UNII-9B04W34BBD

Registry Numbers

CAS Registry Number

  • 1039452-58-8

FDA UNII

  • 9B04W34BBD

System Generated Number

  • 1039452588

Structure Descriptors

InChI

1S/C37H36N2O6S2/c1-3-38(26-28-11-7-5-8-12-28)32-19-15-30(16-20-32)37(35-24-23-34(46(40,41)42)25-36(35)47(43,44)45)31-17-21-33(22-18-31)39(4-2)27-29-13-9-6-10-14-29/h5-25H,3-4,26-27H2,1-2H3,(H-,40,41,42,43,44,45)/p+1

InChIKey

VUXVWHOCQSLYRN-UHFFFAOYSA-O

Smiles

CCN(Cc1ccccc1)c2ccc(cc2)C(=C3C=CC(=[N+](CC)Cc4ccccc4)C=C3)c5ccc(cc5S(=O)(=O)O)S(=O)(=O)O