N-(5-acetamido-2-methoxy-phenyl)-2-(azocan-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-(azocan-1-ium-1-yl)ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-(azocan-1-ium-1-yl)acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-(1-azocan-1-iumyl)acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-(azocan-1-ium-1-yl)acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-(azocan-1-ium-1-yl)acetamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCCCCCC2

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCCCCCC2

InChI

InChI=1S/C18H27N3O3/c1-14(22)19-15-8-9-17(24-2)16(12-15)20-18(23)13-21-10-6-4-3-5-7-11-21/h8-9,12H,3-7,10-11,13H2,1-2H3,(H,19,22)(H,20,23)/p+1