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

Systemtic Name: (4-acetamidophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: (4-acetamidophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid (4-acetamidophenyl) ester Formula: C19H13ClF3N3O3 MolecularWeight: 423.77303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C19H13ClF3N3O3/c1-11(27)25-13-4-8-15(9-5-13)29-18(28)16-10-24-26(17(16)19(21,22)23)14-6-2-12(20)3-7-14/h2-10H,1H3,(H,25,27)