3-(azocan-1-ium-1-yl)-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 3-(azocan-1-ium-1-yl)-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-3-(azocan-1-ium-1-yl)propanamide CAS Name: N-(4-acetylphenyl)-3-(1-azocan-1-iumyl)propanamide IUPAC Name: N-(4-acetylphenyl)-3-(azocan-1-ium-1-yl)propanamide Traditional Name: N-(4-acetylphenyl)-3-(azocan-1-ium-1-yl)propionamide Formula: C18H27N2O2+ MolecularWeight: 303.41918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O2/c1-15(21)16-7-9-17(10-8-16)19-18(22)11-14-20-12-5-3-2-4-6-13-20/h7-10H,2-6,11-14H2,1H3,(H,19,22)/p+1