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Substance Name: Disodium 5-((4-(((4-((6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate
RN: 6661-26-3
InChIKey: ILDOEHXARNMTNN-KNZLDKEQSA-L

Molecular Formula

  • C37-H27-N7-O9-S.2Na

Molecular Weight

  • 789.6905
 
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Names and Synonyms

Synonym

  • EINECS 229-700-6

Systematic Name

  • Disodium 5-((4-(((4-((6-((4-aminobenzoyl)amino)-1-hydroxy-3-sulphonato-2-naphthyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate

Registry Numbers

CAS Registry Number

  • 6661-26-3

System Generated Number

  • 0006661263

Molecular Formulas

Molecular Formula

  • C37-H27-N7-O9-S.2Na

Molecular Formula Fragments

  • C37-H27-N7-O9-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C37H27N7O9S.2Na/c38-23-5-1-20(2-6-23)36(48)40-27-13-15-29-22(17-27)18-32(54(51,52)53)33(34(29)46)44-42-26-11-9-24(10-12-26)39-35(47)21-3-7-25(8-4-21)41-43-28-14-16-31(45)30(19-28)37(49)50;;/h1-19,45-46H,38H2,(H,39,47)(H,40,48)(H,49,50)(H,51,52,53);;/q;2*+1/p-2/b43-41+,44-42+;;

InChIKey

ILDOEHXARNMTNN-KNZLDKEQSA-L

Smiles

c1cc(ccc1C(=O)Nc2ccc3c(c2)cc(c(c3O)/N=N/c4ccc(cc4)NC(=O)c5ccc(cc5)/N=N/c6ccc(c(c6)C(=O)[O-])O)S(=O)(=O)[O-])N.[Na+].[Na+]