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Substance Name: 1,3,5-Naphthalenetrisulfonic acid, 7-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)
RN: 72639-29-3
InChIKey: VPMRIEZGYICHGJ-UEVOHEPMSA-J

Molecular Formula

  • C29-H17-Cl2-N5-O13-S4.4Na

Molecular Weight

  • 930.574
 
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Names and Synonyms

Synonyms

  • 8-(((2,3-Dichloroquinoxalin-6-yl)carbonyl)amino)-5-((1,3,5-trisulfo-7-naphthyl)azo)-1-naphthalenesulfonic acid, tetrasodium salt
  • EINECS 276-752-0

Systematic Names

  • 1,3,5-Naphthalenetrisulfonic acid, 7-((4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)azo)-, tetrasodium salt
  • 1,3,5-Naphthalenetrisulfonic acid, 7-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)
  • Tetrasodium 7-((4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulphonato-1-naphthyl)azo)naphthalene-1,3,5-trisulphonate

Registry Numbers

CAS Registry Number

  • 72639-29-3

System Generated Number

  • 0072639293

Molecular Formulas

Molecular Formula

  • C29-H17-Cl2-N5-O13-S4.4Na

Molecular Formula Fragments

  • C29-H17-Cl2-N5-O13-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H17Cl2N5O13S4.4Na/c30-27-28(31)33-22-8-13(4-5-20(22)32-27)29(37)34-21-7-6-19(16-2-1-3-23(26(16)21)51(41,42)43)36-35-14-9-17-18(24(10-14)52(44,45)46)11-15(50(38,39)40)12-25(17)53(47,48)49;;;;/h1-12H,(H,34,37)(H,38,39,40)(H,41,42,43)(H,44,45,46)(H,47,48,49);;;;/q;4*+1/p-4/b36-35+;;;;

InChIKey

VPMRIEZGYICHGJ-UEVOHEPMSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1(cc(cc2c(cc(cc12)\N=N\c1ccc(c2c(cccc12)S(=O)(=O)[O-])NC(=O)c1cc2nc(c(nc2cc1)Cl)Cl)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]