1-[(2S)-2-azanyl-2-(3-fluoranyl-4-methoxy-phenyl)ethyl]azepan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-(3-fluoranyl-4-methoxy-phenyl)ethyl]azepan-2-one Openeye Name: 1-[(2S)-2-amino-2-(3-fluoro-4-methoxy-phenyl)ethyl]azepan-2-one CAS Name: 1-[(2S)-2-amino-2-(3-fluoro-4-methoxyphenyl)ethyl]-2-azepanone IUPAC Name: 1-[(2S)-2-amino-2-(3-fluoro-4-methoxyphenyl)ethyl]azepan-2-one Traditional Name: 1-[(2S)-2-amino-2-(3-fluoro-4-methoxy-phenyl)ethyl]azepan-2-one Formula: C15H21FN2O2 MolecularWeight: 280.337843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN2CCCCCC2=O)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](CN2CCCCCC2=O)N)F

InChI

InChI=1S/C15H21FN2O2/c1-20-14-7-6-11(9-12(14)16)13(17)10-18-8-4-2-3-5-15(18)19/h6-7,9,13H,2-5,8,10,17H2,1H3/t13-/m1/s1