(4-acetamidophenyl) 1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: (4-acetamidophenyl) 1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: (4-acetamidophenyl) 1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(4-methylphenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 1-(4-methylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(p-tolyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid (4-acetamidophenyl) ester Formula: C20H16F3N3O3 MolecularWeight: 403.35455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OC3=CC=C(C=C3)NC(=O)C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OC3=CC=C(C=C3)NC(=O)C)C(F)(F)F

InChI

InChI=1S/C20H16F3N3O3/c1-12-3-7-15(8-4-12)26-18(20(21,22)23)17(11-24-26)19(28)29-16-9-5-14(6-10-16)25-13(2)27/h3-11H,1-2H3,(H,25,27)