(4-methoxyphenyl)methyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium

Systemtic Name: (4-methoxyphenyl)methyl-[(3S)-2-oxidanylideneazepan-3-yl]azanium Openeye Name: (4-methoxyphenyl)methyl-[(3S)-2-oxoazepan-3-yl]ammonium CAS Name: (4-methoxyphenyl)methyl-[(3S)-2-oxo-3-azepanyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-[(3S)-2-oxoazepan-3-yl]azanium Traditional Name: [(3S)-2-ketoazepan-3-yl]-p-anisyl-ammonium Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]C2CCCCNC2=O

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+][C@H]2CCCCNC2=O

InChI

InChI=1S/C14H20N2O2/c1-18-12-7-5-11(6-8-12)10-16-13-4-2-3-9-15-14(13)17/h5-8,13,16H,2-4,9-10H2,1H3,(H,15,17)/p+1/t13-/m0/s1