Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Cuprate(3-), (4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-7-((1-oxo-3-sulfopropyl)amino)-2-naphthalenesulfonato(5-))-, hydrogen (1:3)
RN: 67859-50-1
InChIKey: KITOSDOMSSSROR-UHFFFAOYSA-L

Molecular Formula

  • C21-H16-Cu-N3-O15-S4.3H

Molecular Weight

  • 745.197
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • Copper, (4-hydroxy-3-((2-hydroxy-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-7-(((2-(sulfo)ethyl)carbonyl)amino)-2-naphthalenesulfonato(2-))-
  • EINECS 267-399-3

Systematic Names

  • Cuprate(3-), (4-(hydroxy-kappaO)-3-((2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo-kappaN1)-7-((1-oxo-3-sulfopropyl)amino)-2-naphthalenesulfonato(5-))-, trihydrogen
  • Cuprate(3-), (4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-5-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-7-((1-oxo-3-sulfopropyl)amino)-2-naphthalenesulfonato(5-))-, hydrogen (1:3)
  • Trihydrogen (4-hydroxy-3-((2-hydroxy-5-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)-7-(3-sulphopropionamido)naphthalene-2-sulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 67859-50-1

System Generated Number

  • 0067859501

Molecular Formulas

Molecular Formula

  • C21-H16-Cu-N3-O15-S4.3H

Molecular Formula Fragments

  • C21-H16-Cu-N3-O15-S4
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C13H13NO8S2.C8H8N2O7S2.Cu/c15-12-7-10(24(20,21)22)6-8-5-9(1-2-11(8)12)14-13(16)3-4-23(17,18)19;9-10-7-5-6(1-2-8(7)11)18(12,13)4-3-17-19(14,15)16;/h1-2,5-7,15H,3-4H2,(H,14,16)(H,17,18,19)(H,20,21,22);1-2,5H,3-4H2,(H-,11,14,15,16);/q;;+2/p-2

InChIKey

KITOSDOMSSSROR-UHFFFAOYSA-L

Smiles

[Cu+2].S(O)(OCCS(c1ccc([O-])c([N+]#N)c1)(=O)=O)(=O)=O.S(O)(=O)(=O)CCC(Nc1cc2cc(cc(c2cc1)[O-])S([O-])(=O)=O)=O