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Substance Name: EINECS 267-118-4
RN: 67800-98-0
InChIKey: NULVMDJQDKBBSE-JRORWHISSA-I

Molecular Formula

  • C29-H17-Cr-N7-O14-S2.3Na

Molecular Weight

  • 872.5863
 
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Names and Synonyms

Results Name

  • EINECS 267-118-4

Synonyms

  • (N-(2-Hydroxy-5-nitro-3-sulfophenyl)salicylaldehydeimino) (1-phenyl-3-methyl-4-(2-hydroxy-5-nitro-3-sulfophenyl)azo-2-pyrazolin-5-one)chromium(III)ate, trisodium
  • EINECS 267-118-4

Systematic Names

  • Chromate(3-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(2-(hydroxy-kappaO)-3-(((2-(hydroxy-kappaO)phenyl)methylene)amino-kappaN)-5-nitrobenzenesulfonato(3-))-, trisodium
  • Chromate(3-), (3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitrobenzenesulfonato(3-))(2-hydroxy-3-(((2-hydroxyphenyl)methylene)amino)-5-nitrobenzenesulfonato(3-)-N3,O2,O3)-, trisodium
  • Chromate(3-), (3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(2-(hydroxy-kappaO)-3-(((2-(hydroxy-kappaO)phenyl)methylene)amino-kappaN)-5-nitrobenzenesulfonato(3-))-, sodium (1:3)

Registry Numbers

CAS Registry Number

  • 67800-98-0

System Generated Number

  • 0067800980

Molecular Formulas

Molecular Formula

  • C29-H17-Cr-N7-O14-S2.3Na

Molecular Formula Fragments

  • C29-H17-Cr-N7-O14-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H12N5O7S.C13H10N2O7S.Cr.3Na/c1-9-14(16(23)20(19-9)10-5-3-2-4-6-10)18-17-12-7-11(21(24)25)8-13(15(12)22)29(26,27)28;16-11-4-2-1-3-8(11)7-14-10-5-9(15(18)19)6-12(13(10)17)23(20,21)22;;;;/h2-8,22H,1H3,(H,26,27,28);1-7,16-17H,(H,20,21,22);;;;/q;;+2;3*+1/p-5/b18-17+;14-7+;;;;

InChIKey

NULVMDJQDKBBSE-JRORWHISSA-I

Smiles

CC1=NN(C(=O)C12N=Nc3cc(cc4c3O[Cr-3]256(Oc7ccccc7/C=N/c8cc(cc(c8O5)S(=O)(=O)O6)[N+](=O)[O-])OS4(=O)=O)[N+](=O)[O-])c9ccccc9.[Na+].[Na+].[Na+]