2-(azocan-1-ium-1-yl)-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-(azocan-1-ium-1-yl)acetamide CAS Name: N-(3-acetylphenyl)-2-(1-azocan-1-iumyl)acetamide IUPAC Name: N-(3-acetylphenyl)-2-(azocan-1-ium-1-yl)acetamide Traditional Name: N-(3-acetylphenyl)-2-(azocan-1-ium-1-yl)acetamide Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CCCCCCC2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CCCCCCC2

InChI

InChI=1S/C17H24N2O2/c1-14(20)15-8-7-9-16(12-15)18-17(21)13-19-10-5-3-2-4-6-11-19/h7-9,12H,2-6,10-11,13H2,1H3,(H,18,21)/p+1