N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethyloxy)phenyl]phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethyloxy)phenyl]phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethoxy)phenyl]phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethoxy)phenyl]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethoxy)phenyl]phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(trifluoromethoxy)phenyl]phenyl]valeramide Formula: C21H21F3N2O2 MolecularWeight: 390.39885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21F3N2O2/c1-14(2)12-19(20(27)26-11-10-25)17-5-3-4-16(13-17)15-6-8-18(9-7-15)28-21(22,23)24/h3-9,13-14,19H,11-12H2,1-2H3,(H,26,27)