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Substance Name: 1,4-Benzenedisulfonic acid, 2-(2-(4-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)
RN: 72639-37-3
InChIKey: LYUGIKBHVABFEQ-RRJCKIETSA-J

Molecular Formula

  • C35-H21-Cl2-N7-O13-S4.4Na

Molecular Weight

  • 1034.69
 
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Names and Synonyms

  • 1,4-Benzenedisulfonic acid, 2-((4-((4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)azo)-7-sulfo-1-naphthalenyl)azo)-, tetrasodium salt
  • 1,4-Benzenedisulfonic acid, 2-(2-(4-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 72639-37-3

System Generated Number

  • 0072639373

Molecular Formulas

Molecular Formula

  • C35-H21-Cl2-N7-O13-S4.4Na

Molecular Formula Fragments

  • C35-H21-Cl2-N7-O13-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C35H21Cl2N7O13S4.4Na/c36-33-34(37)39-28-14-17(4-8-26(28)38-33)35(45)40-27-12-11-24(21-2-1-3-31(32(21)27)61(55,56)57)42-41-23-9-10-25(22-15-18(58(46,47)48)5-7-20(22)23)43-44-29-16-19(59(49,50)51)6-13-30(29)60(52,53)54;;;;/h1-16H,(H,40,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57);;;;/q;4*+1/p-4/b42-41+,44-43+;;;;

InChIKey

LYUGIKBHVABFEQ-RRJCKIETSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1(c(cc(cc1)S(=O)(=O)[O-])\N=N\c1ccc(c2ccc(cc12)S(=O)(=O)[O-])\N=N\c1ccc(c2c(cccc12)S(=O)(=O)[O-])NC(=O)c1cc2nc(c(nc2cc1)Cl)Cl)S(=O)(=O)[O-]