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Substance Name: Sodium 3-((4-((o-tolyl)amino)-5-sulpho-1-naphthyl)azo)-2,1-benzisothiazole-5-sulphonate
RN: 85223-33-2
InChIKey: BZHRKWHVBZJEJG-JGUILPGDSA-M

Molecular Formula

  • C24-H18-N4-O6-S3.Na

Molecular Weight

  • 576.6083
 
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Names and Synonyms

Synonym

  • EINECS 286-388-4

Systematic Name

  • Sodium 3-((4-((o-tolyl)amino)-5-sulpho-1-naphthyl)azo)-2,1-benzisothiazole-5-sulphonate

Registry Numbers

CAS Registry Number

  • 85223-33-2

System Generated Number

  • 0085223332

Molecular Formulas

Molecular Formula

  • C24-H18-N4-O6-S3.Na

Molecular Formula Fragments

  • C24-H18-N4-O6-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H18N4O6S3.Na/c1-14-5-2-3-7-18(14)25-21-12-11-19(16-6-4-8-22(23(16)21)37(32,33)34)26-27-24-17-13-15(36(29,30)31)9-10-20(17)28-35-24;/h2-13,25H,1H3,(H,29,30,31)(H,32,33,34);/q;+1/p-1/b27-26+;

InChIKey

BZHRKWHVBZJEJG-JGUILPGDSA-M

Smiles

[Na+].Cc1ccccc1Nc2ccc(N=Nc3snc4ccc(cc34)S(=O)(=O)[O-])c5cccc(c25)S(=O)(=O)O