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Substance Name: Disodium 5-((4-(((4-((dihydroxy((2-hydroxy-5-((3-sulphonatophenyl)azo)phenyl)azo)phenyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate
RN: 93918-07-1
InChIKey: ABPJHFCGGTXTJD-JKDPXFSMSA-L

Molecular Formula

  • C38-H27-N9-O10-S.2Na

Molecular Weight

  • 845.7145
 
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Names and Synonyms

Synonym

  • EINECS 299-888-2

Systematic Name

  • Disodium 5-((4-(((4-((dihydroxy((2-hydroxy-5-((3-sulphonatophenyl)azo)phenyl)azo)phenyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylate

Registry Numbers

CAS Registry Number

  • 93918-07-1

System Generated Number

  • 0093918071

Molecular Formulas

Molecular Formula

  • C38-H27-N9-O10-S.2Na

Molecular Formula Fragments

  • C38-H27-N9-O10-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C38H27N9O10S.2Na/c48-32-15-12-26(19-29(32)38(53)54)43-40-23-6-4-21(5-7-23)37(52)39-22-8-10-24(11-9-22)41-45-30-14-17-34(50)36(51)35(30)47-46-31-20-27(13-16-33(31)49)44-42-25-2-1-3-28(18-25)58(55,56)57;;/h1-20,48-51H,(H,39,52)(H,53,54)(H,55,56,57);;/q;2*+1/p-2/b43-40+,44-42+,45-41+,47-46+;;

InChIKey

ABPJHFCGGTXTJD-JKDPXFSMSA-L

Smiles

c1cc(cc(c1)S(=O)(=O)[O-])/N=N/c2ccc(c(c2)/N=N/c3c(ccc(c3O)O)/N=N/c4ccc(cc4)NC(=O)c5ccc(cc5)/N=N/c6ccc(c(c6)C(=O)[O-])O)O.[Na+].[Na+]