[(1S)-1-(2-ethoxyphenyl)-2-(2-oxidanylideneazepan-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(2-ethoxyphenyl)-2-(2-oxidanylideneazepan-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(2-ethoxyphenyl)-2-(2-oxoazepan-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(2-ethoxyphenyl)-2-(2-oxo-1-azepanyl)ethyl]ammonium IUPAC Name: [(1S)-1-(2-ethoxyphenyl)-2-(2-oxoazepan-1-yl)ethyl]azanium Traditional Name: [(1S)-2-(2-ketoazepan-1-yl)-1-o-phenetyl-ethyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(CN2CCCCCC2=O)[NH3+]

Isomeric SMILES

CCOC1=CC=CC=C1[C@@H](CN2CCCCCC2=O)[NH3+]

InChI

InChI=1S/C16H24N2O2/c1-2-20-15-9-6-5-8-13(15)14(17)12-18-11-7-3-4-10-16(18)19/h5-6,8-9,14H,2-4,7,10-12,17H2,1H3/p+1/t14-/m1/s1