ethyl 4-ethanoyl-3-oxidanylidene-2-(phenylmethyl)-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-ethanoyl-3-oxidanylidene-2-(phenylmethyl)-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-acetyl-2-benzyl-3-oxo-1H-pyrazole-5-carboxylate CAS Name: 4-acetyl-3-oxo-2-(phenylmethyl)-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-benzyl-3-oxo-1H-pyrazole-5-carboxylate Traditional Name: 4-acetyl-1-benzyl-5-keto-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1)CC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1)CC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C15H16N2O4/c1-3-21-15(20)13-12(10(2)18)14(19)17(16-13)9-11-7-5-4-6-8-11/h4-8,16H,3,9H2,1-2H3