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Substance Name: Disodium (2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoato(2-))(2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-pyrazol-4-yl)azo)benzoato(3-))chromate(2-)
RN: 84682-44-0
InChIKey: DVQCVXRCJZGOMB-CKOIWFHQSA-K

Molecular Formula

  • C34-H23-Cr-N8-O9-S.2Na

Molecular Weight

  • 817.6447
 
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Names and Synonyms

Synonym

  • EINECS 283-608-0

Systematic Name

  • Disodium (2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoato(2-))(2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-pyrazol-4-yl)azo)benzoato(3-))chromate(2-)

Registry Numbers

CAS Registry Number

  • 84682-44-0

System Generated Number

  • 0084682440

Molecular Formulas

Molecular Formula

  • C34-H23-Cr-N8-O9-S.2Na

Molecular Formula Fragments

  • C34-H23-Cr-N8-O9-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H13N4O6S.C17H13N4O3.Cr.2Na/c1-10-15(19-18-14-5-3-2-4-13(14)17(23)24)16(22)21(20-10)11-6-8-12(9-7-11)28(25,26)27;1-11-15(16(22)21(20-11)12-7-3-2-4-8-12)19-18-14-10-6-5-9-13(14)17(23)24;;;/h2-9H,1H3,(H,23,24)(H,25,26,27);2-10H,1H3,(H,23,24);;;/q;;3*+1/p-3/b2*19-18+;;;

InChIKey

DVQCVXRCJZGOMB-CKOIWFHQSA-K

Smiles

[Na+].[Na+].CC1=NN(C(=O)C12N=Nc3ccccc3C(=O)O[Cr-2]245OC(=O)c6ccccc6N=NC47C(=NN(C7=O)c8ccc(cc8)S(=O)(=O)O5)C)c9ccccc9