[(1S)-1-(3-fluoranyl-4-methoxy-phenyl)-2-(2-oxidanylideneazocan-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(3-fluoranyl-4-methoxy-phenyl)-2-(2-oxidanylideneazocan-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(3-fluoro-4-methoxy-phenyl)-2-(2-oxoazocan-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(3-fluoro-4-methoxyphenyl)-2-(2-oxo-1-azocanyl)ethyl]ammonium IUPAC Name: [(1S)-1-(3-fluoro-4-methoxyphenyl)-2-(2-oxoazocan-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(3-fluoro-4-methoxy-phenyl)-2-(2-ketoazocan-1-yl)ethyl]ammonium Formula: C16H24FN2O2+ MolecularWeight: 295.372363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN2CCCCCCC2=O)[NH3+])F

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](CN2CCCCCCC2=O)[NH3+])F

InChI

InChI=1S/C16H23FN2O2/c1-21-15-8-7-12(10-13(15)17)14(18)11-19-9-5-3-2-4-6-16(19)20/h7-8,10,14H,2-6,9,11,18H2,1H3/p+1/t14-/m1/s1