2-cyclopentyl-5-[methyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]pentanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(C#N)(C1CCCC1)C2=CC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCC(C#N)(C1CCCC1)C2=CC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C25H29F3N2/c1-30(18-20-8-3-2-4-9-20)17-7-16-24(19-29,21-10-5-6-11-21)22-12-14-23(15-13-22)25(26,27)28/h2-4,8-9,12-15,21H,5-7,10-11,16-18H2,1H3