2-cyclohexyl-5-[(phenylmethyl)-propyl-amino]-2-[2-(trifluoromethyl)phenyl]pentanenitrile

Systemtic Name: 2-cyclohexyl-5-[(phenylmethyl)-propyl-amino]-2-[2-(trifluoromethyl)phenyl]pentanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-[2-(trifluoromethyl)phenyl]pentanenitrile CAS Name: 2-cyclohexyl-5-[(phenylmethyl)-propylamino]-2-[2-(trifluoromethyl)phenyl]pentanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-[2-(trifluoromethyl)phenyl]pentanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-[2-(trifluoromethyl)phenyl]valeronitrile Formula: C28H35F3N2 MolecularWeight: 456.58611

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1CCCCC1)C2=CC=CC=C2C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

CCCN(CCCC(C#N)(C1CCCCC1)C2=CC=CC=C2C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C28H35F3N2/c1-2-19-33(21-23-12-5-3-6-13-23)20-11-18-27(22-32,24-14-7-4-8-15-24)25-16-9-10-17-26(25)28(29,30)31/h3,5-6,9-10,12-13,16-17,24H,2,4,7-8,11,14-15,18-21H2,1H3