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

Systemtic Name: 2-cyclobutyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]hexanenitrile Openeye Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile CAS Name: 2-cyclobutyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]hexanenitrile IUPAC Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile Traditional Name: 5-[benzyl(methyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]hexanenitrile Formula: C25H29F3N2 MolecularWeight: 414.50637

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)C(F)(F)F)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)C(F)(F)F)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C25H29F3N2/c1-19(30(2)17-20-7-4-3-5-8-20)15-16-24(18-29,21-9-6-10-21)22-11-13-23(14-12-22)25(26,27)28/h3-5,7-8,11-14,19,21H,6,9-10,15-17H2,1-2H3