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Substance Name: Benzoic acid, 5-((4-(2-(6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)benzoyl)amino)-2-hydroxy-, sodium salt (1:2)
RN: 6771-94-4
InChIKey: FVUOWKYUMVGOJA-APVPWGIASA-L

Molecular Formula

  • C31-H23-N5-O9-S.2Na

Molecular Weight

  • 685.579
 
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Names and Synonyms

Synonym

  • EINECS 229-834-5

Systematic Names

  • Benzoic acid, 5-((4-((6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)azo)benzoyl)amino)-2-hydroxy-, disodium salt
  • Benzoic acid, 5-((4-(2-(6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)benzoyl)amino)-2-hydroxy-, sodium salt (1:2)
  • Disodium 5-((4-((6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulphonato-2-naphthyl)azo)benzoyl)amino)salicylate

Registry Numbers

CAS Registry Number

  • 6771-94-4

System Generated Number

  • 0006771944

Molecular Formulas

Molecular Formula

  • C31-H23-N5-O9-S.2Na

Molecular Formula Fragments

  • C31-H23-N5-O9-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C31H23N5O9S.2Na/c32-19-5-1-16(2-6-19)29(39)33-21-9-11-23-18(13-21)14-26(46(43,44)45)27(28(23)38)36-35-20-7-3-17(4-8-20)30(40)34-22-10-12-25(37)24(15-22)31(41)42;;/h1-15,37-38H,32H2,(H,33,39)(H,34,40)(H,41,42)(H,43,44,45);;/q;2*+1/p-2/b36-35+;;

InChIKey

FVUOWKYUMVGOJA-APVPWGIASA-L

Smiles

[Na+].[Na+].C(c1c(ccc(c1)NC(c1ccc(cc1)\N=N\c1c(c2ccc(cc2cc1S(=O)(=O)[O-])NC(c1ccc(cc1)N)=O)O)=O)O)(=O)[O-]