[(3R)-2-oxidanylideneazepan-3-yl]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(3R)-2-oxidanylideneazepan-3-yl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(3R)-2-oxoazepan-3-yl]-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(3R)-2-oxo-3-azepanyl]-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3R)-2-oxoazepan-3-yl]-(2-pyridin-2-ylethyl)azanium Traditional Name: [(3R)-2-ketoazepan-3-yl]-[2-(2-pyridyl)ethyl]ammonium Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)[NH2+]CCC2=CC=CC=N2

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)[NH2+]CCC2=CC=CC=N2

InChI

InChI=1S/C13H19N3O/c17-13-12(6-2-4-9-16-13)15-10-7-11-5-1-3-8-14-11/h1,3,5,8,12,15H,2,4,6-7,9-10H2,(H,16,17)/p+1/t12-/m1/s1