[3-(trifluoromethyl)phenyl]methyl 1,3-diphenylpyrazole-4-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 1,3-diphenylpyrazole-4-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 1,3-diphenylpyrazole-4-carboxylate CAS Name: 1,3-diphenyl-4-pyrazolecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 1,3-diphenylpyrazole-4-carboxylate Traditional Name: 1,3-diphenylpyrazole-4-carboxylic acid [3-(trifluoromethyl)benzyl] ester Formula: C24H17F3N2O2 MolecularWeight: 422.39919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C24H17F3N2O2/c25-24(26,27)19-11-7-8-17(14-19)16-31-23(30)21-15-29(20-12-5-2-6-13-20)28-22(21)18-9-3-1-4-10-18/h1-15H,16H2