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Substance Name: Trisodium bis(2-(4-((1-(4-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-3-hydroxybenzoyl)benzoato(3-))chromate(3-)
RN: 84777-72-0
InChIKey: VXFIPHDYEOSCFF-DHYHKMHWSA-J

Molecular Formula

  • C48-H28-Cl2-Cr-N8-O10.3Na

Molecular Weight

  • 1068.6672
 
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Names and Synonyms

Synonym

  • EINECS 284-101-7

Systematic Name

  • Trisodium bis(2-(4-((1-(4-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-3-hydroxybenzoyl)benzoato(3-))chromate(3-)

Registry Numbers

CAS Registry Number

  • 84777-72-0

System Generated Number

  • 0084777720

Molecular Formulas

Molecular Formula

  • C48-H28-Cl2-Cr-N8-O10.3Na

Molecular Formula Fragments

  • C48-H28-Cl2-Cr-N8-O10
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/2C24H16ClN4O5.Cr.3Na/c2*1-13-21(23(32)29(28-13)16-9-7-15(25)8-10-16)27-26-19-11-6-14(12-20(19)30)22(31)17-4-2-3-5-18(17)24(33)34;;;;/h2*2-12,30H,1H3,(H,33,34);;;;/q;;4*+1/p-4/b2*27-26+;;;;

InChIKey

VXFIPHDYEOSCFF-DHYHKMHWSA-J

Smiles

[Na+].[Na+].[Na+].CC1=NN(C(=O)C12N=Nc3ccc4cc3O[Cr-3]256(OC(=O)c7ccccc7C(=O)c8ccc(N=NC59C(=NN(C9=O)c%10ccc(Cl)cc%10)C)c(O6)c8)OC(=O)c%11ccccc%11C4=O)c%12ccc(Cl)cc%12