(3S)-1-(4-fluorophenyl)carbonyl-3-(methylamino)azepan-2-one

Systemtic Name: (3S)-1-(4-fluorophenyl)carbonyl-3-(methylamino)azepan-2-one Openeye Name: (3S)-1-(4-fluorobenzoyl)-3-(methylamino)azepan-2-one CAS Name: (3S)-1-[(4-fluorophenyl)-oxomethyl]-3-(methylamino)-2-azepanone IUPAC Name: (3S)-1-(4-fluorobenzoyl)-3-(methylamino)azepan-2-one Traditional Name: (3S)-1-(4-fluorobenzoyl)-3-(methylamino)azepan-2-one Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

CNC1CCCCN(C1=O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN[C@H]1CCCCN(C1=O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H17FN2O2/c1-16-12-4-2-3-9-17(14(12)19)13(18)10-5-7-11(15)8-6-10/h5-8,12,16H,2-4,9H2,1H3/t12-/m0/s1