butyl 2-(4-methylphenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylate

Systemtic Name: butyl 2-(4-methylphenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylate Openeye Name: butyl 3-oxo-2-(p-tolyl)-1H-pyrazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylic acid butyl ester IUPAC Name: butyl 2-(4-methylphenyl)-3-oxo-1H-pyrazole-5-carboxylate Traditional Name: 5-keto-1-(p-tolyl)-3-pyrazoline-3-carboxylic acid butyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=O)N(N1)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC(=O)C1=CC(=O)N(N1)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H18N2O3/c1-3-4-9-20-15(19)13-10-14(18)17(16-13)12-7-5-11(2)6-8-12/h5-8,10,16H,3-4,9H2,1-2H3