[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 5-methyl-1-pyridin-2-yl-pyrazole-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 5-methyl-1-pyridin-2-yl-pyrazole-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 5-methyl-1-(2-pyridyl)pyrazole-4-carboxylate CAS Name: 5-methyl-1-(2-pyridinyl)-4-pyrazolecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 5-methyl-1-pyridin-2-ylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-(2-pyridyl)pyrazole-4-carboxylic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(N(N=C2)C3=CC=CC=N3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=C(N(N=C2)C3=CC=CC=N3)C

InChI

InChI=1S/C19H17N3O3/c1-13-6-8-15(9-7-13)17(23)12-25-19(24)16-11-21-22(14(16)2)18-5-3-4-10-20-18/h3-11H,12H2,1-2H3