[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-phenethyl-ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-phenethylammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-phenethylazanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-phenethyl-ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH2+]CCC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH2+]CCC2=CC=CC=C2

InChI

InChI=1S/C16H24N2O/c19-16(18-12-6-1-2-7-13-18)14-17-11-10-15-8-4-3-5-9-15/h3-5,8-9,17H,1-2,6-7,10-14H2/p+1