methyl 5-oxidanylidene-2-(phenylmethyl)-1H-pyrazole-3-carboxylate

Systemtic Name: methyl 5-oxidanylidene-2-(phenylmethyl)-1H-pyrazole-3-carboxylate Openeye Name: methyl 2-benzyl-5-oxo-1H-pyrazole-3-carboxylate CAS Name: 5-oxo-2-(phenylmethyl)-1H-pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-5-oxo-1H-pyrazole-3-carboxylate Traditional Name: 2-benzyl-5-keto-3-pyrazoline-3-carboxylic acid methyl ester Formula: C12H12N2O3 MolecularWeight: 232.23528

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)NN1CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=O)NN1CC2=CC=CC=C2

InChI

InChI=1S/C12H12N2O3/c1-17-12(16)10-7-11(15)13-14(10)8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,13,15)