[4-(2-cyanophenyl)phenyl]methyl 6-(trifluoromethyl)pyridine-3-carboxylate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 6-(trifluoromethyl)pyridine-3-carboxylate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 6-(trifluoromethyl)pyridine-3-carboxylate CAS Name: 6-(trifluoromethyl)-3-pyridinecarboxylic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 6-(trifluoromethyl)pyridine-3-carboxylate Traditional Name: 6-(trifluoromethyl)nicotinic acid [4-(2-cyanophenyl)benzyl] ester Formula: C21H13F3N2O2 MolecularWeight: 382.33533

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)COC(=O)C3=CN=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)COC(=O)C3=CN=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H13F3N2O2/c22-21(23,24)19-10-9-17(12-26-19)20(27)28-13-14-5-7-15(8-6-14)18-4-2-1-3-16(18)11-25/h1-10,12H,13H2