[4-(4-cyanophenyl)phenyl] 3-(trifluoromethyl)benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 3-(trifluoromethyl)benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 3-(trifluoromethyl)benzoate CAS Name: 3-(trifluoromethyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 3-(trifluoromethyl)benzoate Traditional Name: 3-(trifluoromethyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C21H12F3NO2 MolecularWeight: 367.32069

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H12F3NO2/c22-21(23,24)18-3-1-2-17(12-18)20(26)27-19-10-8-16(9-11-19)15-6-4-14(13-25)5-7-15/h1-12H