[2-[[2-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-(2-methoxyethyl)azanium

Systemtic Name: [2-[[2-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-(2-methoxyethyl)azanium Openeye Name: [2-[2-(azepan-1-yl)anilino]-2-oxo-ethyl]-(2-methoxyethyl)ammonium CAS Name: [2-[2-(1-azepanyl)anilino]-2-oxoethyl]-(2-methoxyethyl)ammonium IUPAC Name: [2-[2-(azepan-1-yl)anilino]-2-oxoethyl]-(2-methoxyethyl)azanium Traditional Name: [2-[2-(azepan-1-yl)anilino]-2-keto-ethyl]-(2-methoxyethyl)ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC(=O)NC1=CC=CC=C1N2CCCCCC2

Isomeric SMILES

COCC[NH2+]CC(=O)NC1=CC=CC=C1N2CCCCCC2

InChI

InChI=1S/C17H27N3O2/c1-22-13-10-18-14-17(21)19-15-8-4-5-9-16(15)20-11-6-2-3-7-12-20/h4-5,8-9,18H,2-3,6-7,10-14H2,1H3,(H,19,21)/p+1