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Substance Name: Trisodium (3-((2,4-dihydroxy-5-((2-hydroxy-5-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)phenyl)azo)naphthalene-1,5-disulphonato(5-))cuprate(3-)
RN: 85631-96-5
InChIKey: WYZIEUNAIVFGEU-ZHNZWFLTSA-I

Molecular Formula

  • C24-H15-Cu-N4-O15-S4.3Na

Molecular Weight

  • 860.1755
 
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Names and Synonyms

Synonym

  • EINECS 288-047-5

Systematic Name

  • Trisodium (3-((2,4-dihydroxy-5-((2-hydroxy-5-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)phenyl)azo)naphthalene-1,5-disulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 85631-96-5

System Generated Number

  • 0085631965

Molecular Formulas

Molecular Formula

  • C24-H15-Cu-N4-O15-S4.3Na

Molecular Formula Fragments

  • C24-H15-Cu-N4-O15-S4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H20N4O15S4.Cu.3Na/c29-20-5-4-14(44(32,33)7-6-43-47(40,41)42)10-17(20)27-28-19-11-18(21(30)12-22(19)31)26-25-13-8-16-15(24(9-13)46(37,38)39)2-1-3-23(16)45(34,35)36;;;;/h1-5,8-12,29-31H,6-7H2,(H,34,35,36)(H,37,38,39)(H,40,41,42);;;;/q;+2;3*+1/p-5/b26-25+,28-27+;;;;

InChIKey

WYZIEUNAIVFGEU-ZHNZWFLTSA-I

Smiles

[Na+].[Na+].[Na+].Oc1ccc2cc1N=Nc3cc4N=Nc5cc6c7cccc(c7c5)S(=O)(=O)O[Cu-3]8(Oc4cc3O8)(OS(=O)(=O)OCCS2(=O)=O)OS6(=O)=O