[3-(trifluoromethyl)phenyl]methyl 4-cyanobenzoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 4-cyanobenzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [3-(trifluoromethyl)benzyl] ester Formula: C16H10F3NO2 MolecularWeight: 305.25131

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10F3NO2/c17-16(18,19)14-3-1-2-12(8-14)10-22-15(21)13-6-4-11(9-20)5-7-13/h1-8H,10H2