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Substance Name: Sodium 2'-(4-((2,4-dihydroxy-5-(phenylazo)phenyl)azo)phenyl)-6-methyl(2,6'-bibenzothiazole)-7-sulphonate
RN: 85188-17-6
InChIKey: YGLGUUMAMNNUST-UPLBNUMFSA-M

Molecular Formula

  • C33-H22-N6-O5-S3.Na

Molecular Weight

  • 700.7539
 
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Names and Synonyms

Synonym

  • EINECS 286-207-9

Systematic Name

  • Sodium 2'-(4-((2,4-dihydroxy-5-(phenylazo)phenyl)azo)phenyl)-6-methyl(2,6'-bibenzothiazole)-7-sulphonate

Registry Numbers

CAS Registry Number

  • 85188-17-6

System Generated Number

  • 0085188176

Molecular Formulas

Molecular Formula

  • C33-H22-N6-O5-S3.Na

Molecular Formula Fragments

  • C33-H22-N6-O5-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C33H22N6O5S3.Na/c1-18-7-13-24-30(31(18)47(42,43)44)46-33(35-24)20-10-14-23-29(15-20)45-32(34-23)19-8-11-22(12-9-19)37-39-26-16-25(27(40)17-28(26)41)38-36-21-5-3-2-4-6-21;/h2-17,40-41H,1H3,(H,42,43,44);/q;+1/p-1/b38-36+,39-37+;

InChIKey

YGLGUUMAMNNUST-UPLBNUMFSA-M

Smiles

Cc1ccc2c(c1S(=O)(=O)[O-])sc(n2)c3ccc4c(c3)sc(n4)c5ccc(cc5)/N=N/c6cc(c(cc6O)O)/N=N/c7ccccc7.[Na+]