[4-(cyanomethyl)phenyl] 4-(trifluoromethyl)benzoate

Systemtic Name: [4-(cyanomethyl)phenyl] 4-(trifluoromethyl)benzoate Openeye Name: [4-(cyanomethyl)phenyl] 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid [4-(cyanomethyl)phenyl] ester Formula: C16H10F3NO2 MolecularWeight: 305.25131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CC#N)OC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

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