ethyl 3-oxidanylidene-2-(phenylsulfonyl)-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-oxidanylidene-2-(phenylsulfonyl)-1H-pyrazole-4-carboxylate Openeye Name: ethyl 2-(benzenesulfonyl)-3-oxo-1H-pyrazole-4-carboxylate CAS Name: 2-(benzenesulfonyl)-3-oxo-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzenesulfonyl)-3-oxo-1H-pyrazole-4-carboxylate Traditional Name: 1-besyl-5-keto-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C12H12N2O5S MolecularWeight: 296.29908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN(C1=O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CNN(C1=O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O5S/c1-2-19-12(16)10-8-13-14(11(10)15)20(17,18)9-6-4-3-5-7-9/h3-8,13H,2H2,1H3