2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)hexanenitrile

Systemtic Name: 2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)hexanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)hexanenitrile CAS Name: 2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)hexanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)hexanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)hexanenitrile Formula: C25H31FN2 MolecularWeight: 378.525443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(C)CCC(C#N)(C2CCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(C)CCC(C#N)(C2CCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C25H31FN2/c1-3-28(18-21-8-5-4-6-9-21)20(2)16-17-25(19-27,22-10-7-11-22)23-12-14-24(26)15-13-23/h4-6,8-9,12-15,20,22H,3,7,10-11,16-18H2,1-2H3