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Substance Name: Cuprate(4-), (5-((4-chloro-6-((2-methyl-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-4-sulfo-1-naphthalenyl)diazenyl-kappaN1)-2,7-naphthalenedisulfonato(6-))-, sodium (1:4)
RN: 72906-65-1
InChIKey: XVWIMSXRAXHTDI-UGPCQCMPSA-H

Molecular Formula

  • C30-H16-Cl-Cu-N7-O14-S4.4Na

Molecular Weight

  • 1017.71
 
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Names and Synonyms

Synonym

  • EINECS 277-011-4

Systematic Names

  • Cuprate(4-), (5-((4-chloro-6-((2-methyl-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-(hydroxy-kappaO)-3-((2-(hydroxy-kappaO)-4-sulfo-1-naphthalenyl)azo-kappaN1)-2,7-naphthalenedisulfonato(6-))-, tetrasodium
  • Cuprate(4-), (5-((4-chloro-6-((2-methyl-4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-4-sulfo-1-naphthalenyl)diazenyl-kappaN1)-2,7-naphthalenedisulfonato(6-))-, sodium (1:4)
  • Tetrasodium (5-((4-chloro-6-(4-sulpho-o-toluidino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-4-sulpho-1-naphthyl)azo)naphthalene-2,7-disulphonato(6-))cuprate(4-)

Registry Numbers

CAS Registry Number

  • 72906-65-1

System Generated Number

  • 0072906651

Molecular Formulas

Molecular Formula

  • C30-H16-Cl-Cu-N7-O14-S4.4Na

Molecular Formula Fragments

  • C30-H16-Cl-Cu-N7-O14-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C30H22ClN7O14S4.Cu.4Na/c1-13-8-15(53(41,42)43)6-7-19(13)32-29-34-28(31)35-30(36-29)33-20-11-16(54(44,45)46)9-14-10-23(56(50,51)52)26(27(40)24(14)20)38-37-25-18-5-3-2-4-17(18)22(12-21(25)39)55(47,48)49;;;;;/h2-12,39-40H,1H3,(H,41,42,43)(H,44,45,46)(H,47,48,49)(H,50,51,52)(H2,32,33,34,35,36);;;;;/q;+2;4*+1/p-6/b38-37+;;;;;

InChIKey

XVWIMSXRAXHTDI-UGPCQCMPSA-H

Smiles

[Cu+2].[Na+].c1(S(=O)([O-])=O)ccc(Nc2nc(nc(Nc3c4c(cc(c3)S([O-])(=O)=O)cc(S([O-])(=O)=O)c(\N=N\c3c5c(cccc5)c(S([O-])(=O)=O)cc3[O-])c4[O-])n2)Cl)c(c1)C.[Na+].[Na+].[Na+]