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Substance Name: 1,5-Naphthalenedisulfonic acid, 2-(2-(8-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:4)
RN: 72639-31-7
InChIKey: WNXAOKZZJLIMCW-UEVOHEPMSA-J

Molecular Formula

  • C29-H17-Cl2-N5-O14-S4.4Na

Molecular Weight

  • 946.573
 
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Names and Synonyms

Synonym

  • 4-(((2,3-Dichloro-6-quinoxalinyl)carbonyl)amino)-5-hydroxy-6-((1,5-disulfo-2-naphthyl)azo)-2,7-naphthalenedisulfonic acid, tetrasodium salt

Systematic Names

  • 1,5-Naphthalenedisulfonic acid, 2-((8-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, tetrasodium salt
  • 1,5-Naphthalenedisulfonic acid, 2-(2-(8-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:4)

Registry Numbers

CAS Registry Number

  • 72639-31-7

System Generated Number

  • 0072639317

Molecular Formulas

Molecular Formula

  • C29-H17-Cl2-N5-O14-S4.4Na

Molecular Formula Fragments

  • C29-H17-Cl2-N5-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C29H17Cl2N5O14S4.4Na/c30-27-28(31)33-19-9-12(4-6-17(19)32-27)29(38)34-20-11-14(51(39,40)41)8-13-10-22(53(45,46)47)24(25(37)23(13)20)36-35-18-7-5-15-16(26(18)54(48,49)50)2-1-3-21(15)52(42,43)44;;;;/h1-11,37H,(H,34,38)(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50);;;;/q;4*+1/p-4/b36-35+;;;;

InChIKey

WNXAOKZZJLIMCW-UEVOHEPMSA-J

Smiles

[Na+].[Na+].[Na+].[Na+].c1(c(ccc2c(cccc12)S(=O)(=O)[O-])\N=N\c1c(c2c(cc(cc2cc1S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)c1cc2nc(c(nc2cc1)Cl)Cl)O)S(=O)(=O)[O-]