1-(azepan-1-yl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(2,3-dimethyl-1-imidazol-3-iumyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2,3-dimethylimidazol-3-ium-1-yl)ethanone Formula: C13H22N3O+ MolecularWeight: 236.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1CC(=O)N2CCCCCC2)C

Isomeric SMILES

CC1=[N+](C=CN1CC(=O)N2CCCCCC2)C

InChI

InChI=1S/C13H22N3O/c1-12-14(2)9-10-16(12)11-13(17)15-7-5-3-4-6-8-15/h9-10H,3-8,11H2,1-2H3/q+1