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

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 3-cyanobenzoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 3-cyanobenzoate Traditional Name: 3-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=CC(=C2)C#N

Isomeric SMILES

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

InChI

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