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Substance Name: EINECS 253-192-5
RN: 36759-10-1
InChIKey: MVHOHWZYPOEPSB-ANVLNOONSA-L

Molecular Formula

  • C18-H12-Cu-N3-O14-S4.3H

Molecular Weight

  • 689.133
 
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Names and Synonyms

Results Name

  • EINECS 253-192-5

Synonym

  • EINECS 253-192-5

Systematic Names

  • Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)diazenyl-kappaN1)-1,7-naphthalenedisulfonato(5-))-, hydrogen (1:3)
  • Cuprate(3-), (4-amino-5-hydroxy-6-((2-hydroxy-4-((2-(sulfooxy)ethyl)sulfonyl)phenyl)azo)-1,7-naphthalenedisulfonato(5-))-, trihydrogen
  • Trihydrogen (4-amino-5-hydroxy-6-((2-hydroxy-4-((2-(sulphooxy)ethyl)sulphonyl)phenyl)azo)naphthalene-1,7-disulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 36759-10-1

System Generated Number

  • 0036759101

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/c19-11-2-4-14(37(26,27)28)10-8-15(38(29,30)31)17(18(23)16(10)11)21-20-12-3-1-9(7-13(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

MVHOHWZYPOEPSB-ANVLNOONSA-L

Smiles

c1(c(c([O-])c2c(c1)c(ccc2N)S([O-])(=O)=O)\N=N\c1ccc(S(CCOS(=O)([O-])=O)(=O)=O)cc1[O-])S(=O)(=O)[O-].[Cu+2]