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Substance Name: Benzoic acid, 5-(2-(4-(2-(3-(2-(3-(2-(2,4-diaminophenyl)diazenyl)-2-hydroxy-5-sulfophenyl)diazenyl)-2,6-dihydroxyphenyl)diazenyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:2)
RN: 67874-26-4
InChIKey: JWLRZEVOQGZBHK-FVNPUKQMSA-L

Molecular Formula

  • C31-H24-N10-O9-S.2Na

Molecular Weight

  • 756.622
 
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Names and Synonyms

Synonyms

  • Benzoic acid, 5-((4-((3-((3-((2,4-diaminophenyl)azo)-2-hydroxy-5-sulfophenyl)azo)-2,6-dihydroxyphenyl)azo)phenyl)azo)-2-hydroxy-, disodium salt
  • EINECS 267-463-0

Systematic Names

  • Benzoic acid, 5-((4-((3-((3-((2,4-diaminophenyl)azo)-2-hydroxy-5-sulfophenyl)azo)-2,6-dihydroxyphenyl)azo)phenyl)azo)-2-hydroxy-, disodium salt
  • Benzoic acid, 5-(2-(4-(2-(3-(2-(3-(2-(2,4-diaminophenyl)diazenyl)-2-hydroxy-5-sulfophenyl)diazenyl)-2,6-dihydroxyphenyl)diazenyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:2)
  • Disodium 5-((4-((3-((3-((2,4-diaminophenyl)azo)-2-hydroxy-5-sulphonatophenyl)azo)-2,6-dihydroxyphenyl)azo)phenyl)azo)salicylate

Registry Numbers

CAS Registry Number

  • 67874-26-4

System Generated Number

  • 0067874264

Molecular Formulas

Molecular Formula

  • C31-H24-N10-O9-S.2Na

Molecular Formula Fragments

  • C31-H24-N10-O9-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C31H24N10O9S.2Na/c32-15-1-7-22(21(33)11-15)37-39-24-13-19(51(48,49)50)14-25(29(24)44)40-38-23-8-10-27(43)28(30(23)45)41-35-17-4-2-16(3-5-17)34-36-18-6-9-26(42)20(12-18)31(46)47;;/h1-14,42-45H,32-33H2,(H,46,47)(H,48,49,50);;/q;2*+1/p-2/b36-34+,39-37+,40-38+,41-35+;;

InChIKey

JWLRZEVOQGZBHK-FVNPUKQMSA-L

Smiles

S(c1cc(\N=N\c2c(O)c(c(cc2)O)\N=N\c2ccc(\N=N\c3ccc(c(c3)C([O-])=O)O)cc2)c(c(c1)\N=N\c1c(cc(cc1)N)N)O)(=O)(=O)[O-].[Na+].[Na+]