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

Systemtic Name: 2-cyclobutyl-5-[ethyl(phenethyl)amino]-2-(4-fluorophenyl)heptanenitrile Openeye Name: 2-cyclobutyl-5-[ethyl(phenethyl)amino]-2-(4-fluorophenyl)heptanenitrile CAS Name: 2-cyclobutyl-5-[ethyl(phenethyl)amino]-2-(4-fluorophenyl)heptanenitrile IUPAC Name: 2-cyclobutyl-5-[ethyl(phenethyl)amino]-2-(4-fluorophenyl)heptanenitrile Traditional Name: 2-cyclobutyl-5-[ethyl(phenethyl)amino]-2-(4-fluorophenyl)enanthonitrile Formula: C27H35FN2 MolecularWeight: 406.578603

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)F)N(CC)CCC3=CC=CC=C3

Isomeric SMILES

CCC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)F)N(CC)CCC3=CC=CC=C3

InChI

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