[5-methyl-1-(4-methylphenyl)carbonyl-pyrazol-3-yl] 4-methylbenzoate

Systemtic Name: [5-methyl-1-(4-methylphenyl)carbonyl-pyrazol-3-yl] 4-methylbenzoate Openeye Name: [5-methyl-1-(4-methylbenzoyl)pyrazol-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [5-methyl-1-[(4-methylphenyl)-oxomethyl]-3-pyrazolyl] ester IUPAC Name: [5-methyl-1-(4-methylbenzoyl)pyrazol-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (5-methyl-1-p-toluoyl-pyrazol-3-yl) ester Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(=CC(=N2)OC(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(=CC(=N2)OC(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C20H18N2O3/c1-13-4-8-16(9-5-13)19(23)22-15(3)12-18(21-22)25-20(24)17-10-6-14(2)7-11-17/h4-12H,1-3H3