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Substance Name: Trisodium hydrogen 4,5-dihydro-5-oxo-4-((3-phosphonatophenyl)azo)-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate
RN: 84051-92-3
InChIKey: OUMMOMYMQBTCHM-GLCFPVLVSA-K

Molecular Formula

  • C16-H13-N4-O9-P-S.3Na

Molecular Weight

  • 534.284
 
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Names and Synonyms

Synonym

  • EINECS 281-882-6

Systematic Name

  • Trisodium hydrogen 4,5-dihydro-5-oxo-4-((3-phosphonatophenyl)azo)-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate

Registry Numbers

CAS Registry Number

  • 84051-92-3

System Generated Number

  • 0084051923

Molecular Formulas

Molecular Formula

  • C16-H13-N4-O9-P-S.3Na

Molecular Formula Fragments

  • C16-H13-N4-O9-P-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H13N4O9PS.3Na/c21-15-13(18-17-9-2-1-3-11(8-9)30(24,25)26)14(16(22)23)19-20(15)10-4-6-12(7-5-10)31(27,28)29;;;/h1-8,13H,(H,22,23)(H2,24,25,26)(H,27,28,29);;;/q;3*+1/p-3/b18-17+;;;

InChIKey

OUMMOMYMQBTCHM-GLCFPVLVSA-K

Smiles

c1cc(cc(c1)P(=O)([O-])[O-])/N=N/C2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)[O-])C(=O)O.[Na+].[Na+].[Na+]