2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-[4-(trifluoromethyl)phenyl]pentanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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