ethyl 2-(4-methylphenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-oxo-2-(p-tolyl)-1H-pyrazole-4-carboxylate CAS Name: 2-(4-methylphenyl)-5-oxo-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylphenyl)-5-oxo-1H-pyrazole-4-carboxylate Traditional Name: 3-keto-1-(p-tolyl)-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(NC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CN(NC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H14N2O3/c1-3-18-13(17)11-8-15(14-12(11)16)10-6-4-9(2)5-7-10/h4-8H,3H2,1-2H3,(H,14,16)