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Substance Name: Pentapotassium bis(5-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)naphthalene-2,7-disulphonato(4-))cobaltate(5-)
RN: 79817-89-3
InChIKey: WXDAEMNJYDVMAY-BSMWTNBVSA-F

Molecular Formula

  • C38-H18-Cl2-Co-N16-O20-S4.5K

Molecular Weight

  • 1472.2452
 
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Names and Synonyms

Synonym

  • EINECS 279-312-6

Systematic Name

  • Pentapotassium bis(5-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-hydroxy-5-nitrophenyl)azo)naphthalene-2,7-disulphonato(4-))cobaltate(5-)

Registry Numbers

CAS Registry Number

  • 79817-89-3

System Generated Number

  • 0079817893

Molecular Formulas

Molecular Formula

  • C38-H18-Cl2-Co-N16-O20-S4.5K

Molecular Formula Fragments

  • C38-H18-Cl2-Co-N16-O20-S4
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/2C19H13ClN8O10S2.Co.5K/c2*20-17-23-18(21)25-19(24-17)22-11-6-9(39(33,34)35)3-7-4-13(40(36,37)38)15(16(30)14(7)11)27-26-10-5-8(28(31)32)1-2-12(10)29;;;;;;/h2*1-6,29-30H,(H,33,34,35)(H,36,37,38)(H3,21,22,23,24,25);;;;;;/q;;+3;5*+1/p-8/b2*27-26+;;;;;;

InChIKey

WXDAEMNJYDVMAY-BSMWTNBVSA-F

Smiles

c1c(cc\2c(c1)O[Co-5]34567(OS(=O)(=O)c8c(c(c9c(cc(cc9c8)S(=O)(=O)O3)Nc1nc(nc(n1)N)Cl)O4)/N=N/c1c(ccc(c1)[N+](=O)[O-])O5)OS(=O)(=O)c1c(c(c3c(cc(cc3c1)S(=O)(=O)O6)Nc1nc(nc(n1)N)Cl)O7)/N=N2)[N+](=O)[O-].[K+].[K+].[K+].[K+].[K+]