2-(azepan-1-ium-1-yl)-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(2-methylphenyl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(o-tolyl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-(2-methylphenyl)acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(2-methylphenyl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-(o-tolyl)acetamide Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C[NH+]2CCCCCC2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C[NH+]2CCCCCC2

InChI

InChI=1S/C15H22N2O/c1-13-8-4-5-9-14(13)16-15(18)12-17-10-6-2-3-7-11-17/h4-5,8-9H,2-3,6-7,10-12H2,1H3,(H,16,18)/p+1