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Substance Name: 3,3'-(Carbonyldiimino)bis(6-((2-oxo-1-(((4-sulphophenyl)amino)carbonyl)propyl)azo)benzoic acid) sodium salt
RN: 83249-30-3
InChIKey: HGKOMMCIIIKIAN-INRNMLHDSA-J

Molecular Formula

  • C35-H30-N8-O15-S2.x-Na

Molecular Weight

  • 954.7234
 
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Names and Synonyms

Synonym

  • EINECS 280-298-9

Systematic Name

  • 3,3'-(Carbonyldiimino)bis(6-((2-oxo-1-(((4-sulphophenyl)amino)carbonyl)propyl)azo)benzoic acid) sodium salt

Registry Numbers

CAS Registry Number

  • 83249-30-3

System Generated Number

  • 0083249303

Molecular Formulas

Molecular Formula

  • C35-H30-N8-O15-S2.x-Na

Molecular Formula Fragments

  • C35-H30-N8-O15-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C35H30N8O15S2.4Na/c1-17(44)29(31(46)36-19-3-9-23(10-4-19)59(53,54)55)42-40-27-13-7-21(15-25(27)33(48)49)38-35(52)39-22-8-14-28(26(16-22)34(50)51)41-43-30(18(2)45)32(47)37-20-5-11-24(12-6-20)60(56,57)58;;;;/h3-16,29-30H,1-2H3,(H,36,46)(H,37,47)(H,48,49)(H,50,51)(H2,38,39,52)(H,53,54,55)(H,56,57,58);;;;/q;4*+1/p-4/b42-40+,43-41+;;;;

InChIKey

HGKOMMCIIIKIAN-INRNMLHDSA-J

Smiles

CC(=O)C(/N=N/c1c(cc(cc1)NC(=O)Nc2cc(c(cc2)/N=N/C(C(=O)Nc3ccc(cc3)S(=O)(=O)[O-])C(=O)C)C(=O)[O-])C(=O)[O-])C(=O)Nc4ccc(cc4)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]