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Substance Name: Tetrasodium 4,4'-bis((2-methoxy-5-methyl-4-((3-sulphonatophenyl)azo)phenyl)-O,N,N-azoxy)stilbene-2,2'-disulphonate
RN: 83817-39-4
InChIKey: NHBROIIIECHYQJ-JYCBQWJVSA-J

Molecular Formula

  • C42-H36-N8-O16-S4.4Na

Molecular Weight

  • 1124.9788
 
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Names and Synonyms

Synonym

  • EINECS 280-940-8

Systematic Name

  • Tetrasodium 4,4'-bis((2-methoxy-5-methyl-4-((3-sulphonatophenyl)azo)phenyl)-O,N,N-azoxy)stilbene-2,2'-disulphonate

Registry Numbers

CAS Registry Number

  • 83817-39-4

System Generated Number

  • 0083817394

Molecular Formulas

Molecular Formula

  • C42-H36-N8-O16-S4.4Na

Molecular Formula Fragments

  • C42-H36-N8-O16-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C42H36N8O16S4.4Na/c1-25-17-37(39(65-3)23-35(25)45-43-29-7-5-9-33(19-29)67(53,54)55)49(51)47-31-15-13-27(41(21-31)69(59,60)61)11-12-28-14-16-32(22-42(28)70(62,63)64)48-50(52)38-18-26(2)36(24-40(38)66-4)46-44-30-8-6-10-34(20-30)68(56,57)58;;;;/h5-24H,1-4H3,(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64);;;;/q;4*+1/p-4/b12-11+,45-43+,46-44+,49-47+,50-48+;;;;

InChIKey

NHBROIIIECHYQJ-JYCBQWJVSA-J

Smiles

Cc1c(cc(c(c1)/[N+](=N\c2cc(c(cc2)/C=C/c3c(cc(cc3)/N=[N+](/[O-])\c4c(cc(c(c4)C)/N=N/c5cc(ccc5)S(=O)(=O)[O-])OC)S(=O)(=O)[O-])S(=O)(=O)[O-])/[O-])OC)/N=N/c6cc(ccc6)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]