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Substance Name: Trisodium bis(2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-5-sulphobenzoato(3-))chromate(3-)
RN: 83027-58-1
InChIKey: FDKUWFHPPPNJTL-DFHSUBHDSA-J

Molecular Formula

  • C34-H22-Cr-N8-O12-S2.3Na

Molecular Weight

  • 919.6898
 
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Names and Synonyms

Synonym

  • EINECS 280-160-8

Systematic Names

  • Chromate(3-), bis(2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-5-sulfobenzoato(3-))-, trisodium
  • Trisodium bis(2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-5-sulphobenzoato(3-))chromate(3-)

Registry Numbers

CAS Registry Number

  • 83027-58-1

System Generated Number

  • 0083027581

Molecular Formulas

Molecular Formula

  • C34-H22-Cr-N8-O12-S2.3Na

Molecular Formula Fragments

  • C34-H22-Cr-N8-O12-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/2C17H13N4O6S.Cr.3Na/c2*1-10-15(16(22)21(20-10)11-5-3-2-4-6-11)19-18-14-8-7-12(28(25,26)27)9-13(14)17(23)24;;;;/h2*2-9H,1H3,(H,23,24)(H,25,26,27);;;;/q;;4*+1/p-4/b2*19-18+;;;;

InChIKey

FDKUWFHPPPNJTL-DFHSUBHDSA-J

Smiles

CC1=NN(C(=O)C1\2[Cr-3]345(OS(=O)(=O)c6cc(c(cc6)/N=N2)C(=O)O3)OS(=O)(=O)c7cc(c(cc7)/N=N/C48C(=O)N(N=C8C)c9ccccc9)C(=O)O5)c1ccccc1.[Na+].[Na+].[Na+]