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Substance Name: Tetrasodium 5-((4-(2-(4-((4-((3-carboxylato-4-hydroxyphenyl)azo)phenyl)-NNO-azoxy)-2-sulphonatophenyl)vinyl)-3-sulphonatophenyl)-ONN-azoxy)salicylate
RN: 93982-67-3
InChIKey: WZGXIUTXUBRHKM-NEVUESMKSA-J

Molecular Formula

  • C34-H24-N6-O14-S2.4Na

Molecular Weight

  • 892.652
 
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Names and Synonyms

Synonym

  • EINECS 301-256-9

Systematic Name

  • Tetrasodium 5-((4-(2-(4-((4-((3-carboxylato-4-hydroxyphenyl)azo)phenyl)-NNO-azoxy)-2-sulphonatophenyl)vinyl)-3-sulphonatophenyl)-ONN-azoxy)salicylate

Registry Numbers

CAS Registry Number

  • 93982-67-3

System Generated Number

  • 0093982673

Molecular Formulas

Molecular Formula

  • C34-H24-N6-O14-S2.4Na

Molecular Formula Fragments

  • C34-H24-N6-O14-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C34H24N6O14S2.4Na/c41-29-13-9-23(15-27(29)33(43)44)36-35-21-5-7-22(8-6-21)37-39(47)25-11-3-19(31(17-25)55(49,50)51)1-2-20-4-12-26(18-32(20)56(52,53)54)40(48)38-24-10-14-30(42)28(16-24)34(45)46;;;;/h1-18,41-42H,(H,43,44)(H,45,46)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4/b2-1+,36-35+,39-37-,40-38-;;;;

InChIKey

WZGXIUTXUBRHKM-NEVUESMKSA-J

Smiles

c1cc(ccc1/N=N/c2ccc(c(c2)C(=O)[O-])O)/N=[N+](/c3ccc(c(c3)S(=O)(=O)[O-])/C=C/c4ccc(cc4S(=O)(=O)[O-])/[N+](=N/c5ccc(c(c5)C(=O)[O-])O)/[O-])\[O-].[Na+].[Na+].[Na+].[Na+]