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Substance Name: 1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-4-((4-sulfophenyl)azo)-, ion(3-)
RN: 82182-01-2
InChIKey: RFKITWRHKUYMRJ-ISLYRVAYSA-K

Molecular Formula

  • C16-H9-N4-O9-S2

Molecular Weight

  • 465.3981
 
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Names and Synonyms

  • 1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-4-((4-sulfophenyl)azo)-, ion(3-)

Registry Numbers

CAS Registry Number

  • 82182-01-2

System Generated Number

  • 0082182012

Structure Descriptors

InChI

1S/C16H12N4O9S2/c21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29/h1-8,13H,(H,22,23)(H,24,25,26)(H,27,28,29)/p-3/b18-17+

InChIKey

RFKITWRHKUYMRJ-ISLYRVAYSA-K

Smiles

c1cc(ccc1/N=N/C2C(=NN(C2=O)c3ccc(cc3)S(=O)(=O)[O-])C(=O)[O-])S(=O)(=O)[O-]