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Substance Name: Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-1,3-naphthalenedisulfonato(5-))-, hydrogen (1:3)
RN: 15188-78-0
InChIKey: RXJHTIWDZCOYIU-ANVLNOONSA-L

Molecular Formula

  • C18-H12-Cu-N3-O14-S4.3H

Molecular Weight

  • 689.133
 
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Names and Synonyms

Synonym

  • EINECS 239-239-2

Systematic Names

  • Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-((2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo-kappaN1)-1,3-naphthalenedisulfonato(5-))-, trihydrogen
  • Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-1,3-naphthalenedisulfonato(5-))-, hydrogen (1:3)
  • Trihydrogen (4-amino-5-hydroxy-6-((2-hydroxy-5-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)naphthalene-1,3-disulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 15188-78-0

System Generated Number

  • 0015188780

Molecular Formulas

Molecular Formula

  • C18-H12-Cu-N3-O14-S4.3H

Molecular Formula Fragments

  • C18-H12-Cu-N3-O14-S4
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C18H17N3O14S4.Cu/c19-17-15(38(29,30)31)8-14(37(26,27)28)10-2-3-11(18(23)16(10)17)20-21-12-7-9(1-4-13(12)22)36(24,25)6-5-35-39(32,33)34;/h1-4,7-8,22-23H,5-6,19H2,(H,26,27,28)(H,29,30,31)(H,32,33,34);/q;+2/p-2/b21-20+;

InChIKey

RXJHTIWDZCOYIU-ANVLNOONSA-L

Smiles

[Cu+2].c1(c2ccc(\N=N\c3c(ccc(c3)S(CCOS([O-])(=O)=O)(=O)=O)[O-])c(c2c(c(S([O-])(=O)=O)c1)N)[O-])S([O-])(=O)=O