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

Systemtic Name: 2-cyclopropyl-5-[ethyl-(phenylmethyl)amino]-2-(2-fluorophenyl)heptanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(2-fluorophenyl)heptanenitrile CAS Name: 2-cyclopropyl-5-[ethyl-(phenylmethyl)amino]-2-(2-fluorophenyl)heptanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(2-fluorophenyl)heptanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-cyclopropyl-2-(2-fluorophenyl)enanthonitrile Formula: C25H31FN2 MolecularWeight: 378.525443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CC1)C2=CC=CC=C2F)N(CC)CC3=CC=CC=C3

Isomeric SMILES

CCC(CCC(C#N)(C1CC1)C2=CC=CC=C2F)N(CC)CC3=CC=CC=C3

InChI

InChI=1S/C25H31FN2/c1-3-22(28(4-2)18-20-10-6-5-7-11-20)16-17-25(19-27,21-14-15-21)23-12-8-9-13-24(23)26/h5-13,21-22H,3-4,14-18H2,1-2H3