1-[(4-fluorophenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one

Systemtic Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one Openeye Name: 1-[(4-fluorophenyl)methyl]-5-[methyl-[2-(2-pyridyl)ethyl]amino]azepan-2-one CAS Name: 1-[(4-fluorophenyl)methyl]-5-[methyl-[2-(2-pyridinyl)ethyl]amino]-2-azepanone IUPAC Name: 1-[(4-fluorophenyl)methyl]-5-[methyl(2-pyridin-2-ylethyl)amino]azepan-2-one Traditional Name: 1-(4-fluorobenzyl)-5-[methyl-[2-(2-pyridyl)ethyl]amino]azepan-2-one Formula: C21H26FN3O MolecularWeight: 355.449043

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O/c1-24(14-11-19-4-2-3-13-23-19)20-9-10-21(26)25(15-12-20)16-17-5-7-18(22)8-6-17/h2-8,13,20H,9-12,14-16H2,1H3