[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 1,5-dimethylpyrazole-4-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 1,5-dimethylpyrazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 1,5-dimethylpyrazole-4-carboxylate CAS Name: 1,5-dimethyl-4-pyrazolecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 1,5-dimethylpyrazole-4-carboxylate Traditional Name: 1,5-dimethylpyrazole-4-carboxylic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=C(N(N=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=C(N(N=C2)C)C

InChI

InChI=1S/C16H18N2O3/c1-10-5-7-13(8-6-10)15(19)12(3)21-16(20)14-9-17-18(4)11(14)2/h5-9,12H,1-4H3