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Substance Name: Tetrasodium 4-((1-hydroxy-6-((((5-hydroxy-6-((2-methyl-4-sulphonatophenyl)azo)-7-sulphonato-2-naphthyl)amino)carbonyl)amino)-3-sulphonato-2-naphthyl)azo)benzoate
RN: 65072-27-7
InChIKey: ZWLSUPJXSLPRJM-RRJGSHPESA-J

Molecular Formula

  • C35-H26-N6-O14-S3.4Na

Molecular Weight

  • 938.745
 
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Names and Synonyms

Synonym

  • EINECS 265-365-2

Systematic Name

  • Tetrasodium 4-((1-hydroxy-6-((((5-hydroxy-6-((2-methyl-4-sulphonatophenyl)azo)-7-sulphonato-2-naphthyl)amino)carbonyl)amino)-3-sulphonato-2-naphthyl)azo)benzoate

Registry Numbers

CAS Registry Number

  • 65072-27-7

System Generated Number

  • 0065072277

Molecular Formulas

Molecular Formula

  • C35-H26-N6-O14-S3.4Na

Molecular Formula Fragments

  • C35-H26-N6-O14-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C35H26N6O14S3.4Na/c1-17-12-24(56(47,48)49)8-11-27(17)39-41-31-29(58(53,54)55)16-20-14-23(7-10-26(20)33(31)43)37-35(46)36-22-6-9-25-19(13-22)15-28(57(50,51)52)30(32(25)42)40-38-21-4-2-18(3-5-21)34(44)45;;;;/h2-16,42-43H,1H3,(H,44,45)(H2,36,37,46)(H,47,48,49)(H,50,51,52)(H,53,54,55);;;;/q;4*+1/p-4/b40-38+,41-39+;;;;

InChIKey

ZWLSUPJXSLPRJM-RRJGSHPESA-J

Smiles

S(=O)(=O)([O-])c1ccc(\N=N\c2c(c3ccc(cc3cc2S([O-])(=O)=O)NC(Nc2cc3cc(S(=O)(=O)[O-])c(\N=N\c4ccc(C(=O)[O-])cc4)c(O)c3cc2)=O)O)c(C)c1.[Na+].[Na+].[Na+].[Na+]