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Substance Name: EINECS 274-485-4
RN: 70236-54-3
InChIKey: DIRAICVAJNONFF-YKPUJPTISA-I

Molecular Formula

  • C20-H8-Cl3-Cu-N6-O11-S3.3Na

Molecular Weight

  • 843.387
 
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Names and Synonyms

Results Name

  • EINECS 274-485-4

Synonyms

  • (4-Amino-5-hydroxy-6-((2-hydroxy-3-sulfo-5-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo)-1,3-naphthalenedisulfonato(5-))cuprate(3-), trisodium
  • EINECS 274-485-4

Systematic Names

  • Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-((2-(hydroxy-kappaO)-3-sulfo-5-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo-kappaN1)-1,3-naphthalenedisulfonato(5-))-, trisodium
  • Cuprate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-3-sulfo-5-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)diazenyl-kappaN1)-1,3-naphthalenedisulfonato(5-))-, sodium (1:3)
  • Trisodium (4-amino-5-hydroxy-6-((2-hydroxy-3-sulpho-5-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo)naphthalene-1,3-disulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 70236-54-3

System Generated Number

  • 0070236543

Molecular Formulas

Molecular Formula

  • C20-H8-Cl3-Cu-N6-O11-S3.3Na

Molecular Formula Fragments

  • C20-H8-Cl3-Cu-N6-O11-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H13Cl3N6O11S3.Cu.3Na/c21-14-18(22)26-20(23)27-19(14)25-6-3-9(16(30)12(4-6)43(38,39)40)29-28-8-2-1-7-10(41(32,33)34)5-11(42(35,36)37)15(24)13(7)17(8)31;;;;/h1-5,30-31H,24H2,(H,25,26,27)(H,32,33,34)(H,35,36,37)(H,38,39,40);;;;/q;+2;3*+1/p-5/b29-28+;;;;

InChIKey

DIRAICVAJNONFF-YKPUJPTISA-I

Smiles

[Cu+2].[Na+].Clc1nc(c(c(Nc2cc(\N=N\c3c([O-])c4c(c(S(=O)(=O)[O-])cc(S(=O)([O-])=O)c4cc3)N)c([O-])c(S([O-])(=O)=O)c2)n1)Cl)Cl.[Na+].[Na+]