[2-(trifluoromethyl)phenyl]methyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-(trifluoromethyl)benzyl] ester Formula: C22H14F3NO2S MolecularWeight: 413.41227

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C(F)(F)F

InChI

InChI=1S/C22H14F3NO2S/c23-22(24,25)18-10-4-1-8-16(18)14-28-21(27)17-9-3-6-12-20(17)29-19-11-5-2-7-15(19)13-26/h1-12H,14H2