2-(4-chlorophenyl)-2-cyclobutyl-5-[methyl-(phenylmethyl)amino]heptanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[methyl-(phenylmethyl)amino]heptanenitrile Openeye Name: 5-[benzyl(methyl)amino]-2-(4-chlorophenyl)-2-cyclobutyl-heptanenitrile CAS Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[methyl-(phenylmethyl)amino]heptanenitrile IUPAC Name: 5-[benzyl(methyl)amino]-2-(4-chlorophenyl)-2-cyclobutylheptanenitrile Traditional Name: 5-[benzyl(methyl)amino]-2-(4-chlorophenyl)-2-cyclobutyl-enanthonitrile Formula: C25H31ClN2 MolecularWeight: 394.98004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31ClN2/c1-3-24(28(2)18-20-8-5-4-6-9-20)16-17-25(19-27,21-10-7-11-21)22-12-14-23(26)15-13-22/h4-6,8-9,12-15,21,24H,3,7,10-11,16-18H2,1-2H3