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

Systemtic Name: 2-cyclohexyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)hexanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)hexanenitrile CAS Name: 2-cyclohexyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)hexanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)hexanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclohexyl-2-(4-fluorophenyl)hexanenitrile Formula: C27H35FN2 MolecularWeight: 406.578603

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(C)CCC(C#N)(C2CCCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(C)CCC(C#N)(C2CCCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C27H35FN2/c1-3-30(20-23-10-6-4-7-11-23)22(2)18-19-27(21-29,24-12-8-5-9-13-24)25-14-16-26(28)17-15-25/h4,6-7,10-11,14-17,22,24H,3,5,8-9,12-13,18-20H2,1-2H3