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

Systemtic Name: 2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)heptanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)heptanenitrile CAS Name: 2-cyclobutyl-5-[ethyl-(phenylmethyl)amino]-2-(4-fluorophenyl)heptanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)heptanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)enanthonitrile Formula: C26H33FN2 MolecularWeight: 392.552023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33FN2/c1-3-25(29(4-2)19-21-9-6-5-7-10-21)17-18-26(20-28,22-11-8-12-22)23-13-15-24(27)16-14-23/h5-7,9-10,13-16,22,25H,3-4,8,11-12,17-19H2,1-2H3