2-cyclopropyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]hexanenitrile

Systemtic Name: 2-cyclopropyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]hexanenitrile Openeye Name: 5-[benzyl(methyl)amino]-2-cyclopropyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile CAS Name: 2-cyclopropyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]hexanenitrile IUPAC Name: 5-[benzyl(methyl)amino]-2-cyclopropyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile Traditional Name: 5-[benzyl(methyl)amino]-2-cyclopropyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile Formula: C24H27F3N2 MolecularWeight: 400.47979

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C#N)(C1CC1)C2=CC=C(C=C2)C(F)(F)F)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(CCC(C#N)(C1CC1)C2=CC=C(C=C2)C(F)(F)F)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C24H27F3N2/c1-18(29(2)16-19-6-4-3-5-7-19)14-15-23(17-28,20-8-9-20)21-10-12-22(13-11-21)24(25,26)27/h3-7,10-13,18,20H,8-9,14-16H2,1-2H3