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

Systemtic Name: 2-cyclopentyl-5-[ethyl-(phenylmethyl)amino]-2-(2-fluorophenyl)heptanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclopentyl-2-(2-fluorophenyl)heptanenitrile CAS Name: 2-cyclopentyl-5-[ethyl-(phenylmethyl)amino]-2-(2-fluorophenyl)heptanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclopentyl-2-(2-fluorophenyl)heptanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclopentyl-2-(2-fluorophenyl)enanthonitrile Formula: C27H35FN2 MolecularWeight: 406.578603

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCCC1)C2=CC=CC=C2F)N(CC)CC3=CC=CC=C3

Isomeric SMILES

CCC(CCC(C#N)(C1CCCC1)C2=CC=CC=C2F)N(CC)CC3=CC=CC=C3

InChI

InChI=1S/C27H35FN2/c1-3-24(30(4-2)20-22-12-6-5-7-13-22)18-19-27(21-29,23-14-8-9-15-23)25-16-10-11-17-26(25)28/h5-7,10-13,16-17,23-24H,3-4,8-9,14-15,18-20H2,1-2H3