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Substance Name: Cuprate(5-), (2-(2-(4-chloro-6-((2-methyl-5-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-6-(2-(4-((2,5-disulfophenyl)diazenyl)-2-(hydroxy-kappaO)-5-methylphenyl)diazenyl-kappaN1)-5-(hydroxy-kappaO)-1,7-naphthalenedisulfonato(7-))-, sodium (1:5)
RN: 68133-81-3
InChIKey: YZGNUTDCYXAXTG-NUIQIBEWSA-G

Molecular Formula

  • C33-H19-Cl-Cu-N9-O17-S5.5Na

Molecular Weight

  • 1187.84
 
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Names and Synonyms

Synonyms

  • 6-((4-((2,5-Disulfophenyl)azo)-6-hydroxy-3-methyl-phenyl)azo)-2-((4-chloro-6-((2-methyl-5-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino-5-hydroxy-1,7-naphthalenedisulfonic acid, copper complex (1:1)
  • EINECS 268-707-9

Systematic Names

  • Cuprate(5-), (2-((4-chloro-6-((2-methyl-5-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-6-((4-((2,5-disulfophenyl)azo)-2-(hydroxy-kappaO)-5-methylphenyl)azo-kappaN1)-5-(hydroxy-kappaO)-1,7-naphthalenedisulfonato(7-))-, pentasodium
  • Cuprate(5-), (2-((4-chloro-6-((2-methyl-5-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-6-((4-((2,5-disulfophenyl)azo)-2-hydroxy-5-methylphenyl)azo)-5-hydroxy-1,7-naphthalenedisulfonato(7-))-, pentasodium
  • Cuprate(5-), (2-(2-(4-chloro-6-((2-methyl-5-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-6-(2-(4-((2,5-disulfophenyl)diazenyl)-2-(hydroxy-kappaO)-5-methylphenyl)diazenyl-kappaN1)-5-(hydroxy-kappaO)-1,7-naphthalenedisulfonato(7-))-, sodium (1:5)

Registry Numbers

CAS Registry Number

  • 68133-81-3

System Generated Number

  • 0068133813

Molecular Formulas

Molecular Formula

  • C33-H19-Cl-Cu-N9-O17-S5.5Na

Molecular Formula Fragments

  • C33-H19-Cl-Cu-N9-O17-S5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C33H26ClN9O17S5.Cu.5Na/c1-14-3-4-16(61(46,47)48)10-21(14)36-33-38-31(34)37-32(39-33)35-20-7-6-18-19(30(20)65(58,59)60)12-27(64(55,56)57)28(29(18)45)43-41-23-9-15(2)22(13-25(23)44)40-42-24-11-17(62(49,50)51)5-8-26(24)63(52,53)54;;;;;;/h3-13,44-45H,1-2H3,(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H2,35,36,37,38,39);;;;;;/q;+2;5*+1/p-7/b42-40+,43-41+;;;;;;

InChIKey

YZGNUTDCYXAXTG-NUIQIBEWSA-G

Smiles

[Cu+2].[Na+].S(=O)(=O)(c1cc(Nc2nc(nc(Nc3c(S([O-])(=O)=O)c4cc(S([O-])(=O)=O)c(\N=N\c5c([O-])cc(\N=N\c6c(S([O-])(=O)=O)ccc(S([O-])(=O)=O)c6)c(C)c5)c([O-])c4cc3)n2)Cl)c(cc1)C)[O-].[Na+].[Na+].[Na+].[Na+]