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Substance Name: Trisodium (6-(((2,3-dichloroquinoxalin-6-yl)carbonyl)amino)-4-hydroxy-3-((2-hydroxy-5-sulphophenyl)azo)naphthalene-2,7-disulphonato(5-))cuprate(3-)
RN: 83417-35-0
InChIKey: OZJDXZXXEASKLD-JKDBTGEISA-I

Molecular Formula

  • C25-H10-Cl2-Cu-N5-O12-S3.3Na

Molecular Weight

  • 871.997
 
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Names and Synonyms

Synonym

  • EINECS 280-449-9

Systematic Name

  • Trisodium (6-(((2,3-dichloroquinoxalin-6-yl)carbonyl)amino)-4-hydroxy-3-((2-hydroxy-5-sulphophenyl)azo)naphthalene-2,7-disulphonato(5-))cuprate(3-)

Registry Numbers

CAS Registry Number

  • 83417-35-0

System Generated Number

  • 0083417350

Molecular Formulas

Molecular Formula

  • C25-H10-Cl2-Cu-N5-O12-S3.3Na

Molecular Formula Fragments

  • C25-H10-Cl2-Cu-N5-O12-S3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C25H15Cl2N5O12S3.Cu.3Na/c26-23-24(27)29-15-5-10(1-3-14(15)28-23)25(35)30-17-9-13-11(6-19(17)46(39,40)41)7-20(47(42,43)44)21(22(13)34)32-31-16-8-12(45(36,37)38)2-4-18(16)33;;;;/h1-9,33-34H,(H,30,35)(H,36,37,38)(H,39,40,41)(H,42,43,44);;;;/q;+2;3*+1/p-5/b32-31+;;;;

InChIKey

OZJDXZXXEASKLD-JKDBTGEISA-I

Smiles

c1cc2c(cc1C(=O)Nc3cc4c5cc3S(=O)(=O)O[Cu-3]678Oc9ccc(cc9/N=N/c(c4O6)c(c5)S(=O)(=O)O7)S(=O)(=O)O8)nc(c(n2)Cl)Cl.[Na+].[Na+].[Na+]