(phenylmethyl) 2-ethanoyl-3,4-dihydropyrazole-3-carboxylate

Systemtic Name: (phenylmethyl) 2-ethanoyl-3,4-dihydropyrazole-3-carboxylate Openeye Name: benzyl 2-acetyl-3,4-dihydropyrazole-3-carboxylate CAS Name: 2-acetyl-3,4-dihydropyrazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-3,4-dihydropyrazole-3-carboxylate Traditional Name: 2-acetyl-2-pyrazoline-3-carboxylic acid benzyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC=N1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N1C(CC=N1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O3/c1-10(16)15-12(7-8-14-15)13(17)18-9-11-5-3-2-4-6-11/h2-6,8,12H,7,9H2,1H3