2-(1,4-diazepan-4-ium-1-yl)-N-phenyl-ethanamide

Systemtic Name: 2-(1,4-diazepan-4-ium-1-yl)-N-phenyl-ethanamide Openeye Name: 2-(1,4-diazepan-4-ium-1-yl)-N-phenyl-acetamide CAS Name: 2-(1,4-diazepan-4-ium-1-yl)-N-phenylacetamide IUPAC Name: 2-(1,4-diazepan-4-ium-1-yl)-N-phenylacetamide Traditional Name: 2-(1,4-diazepan-4-ium-1-yl)-N-phenyl-acetamide Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1C[NH2+]CCN(C1)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H19N3O/c17-13(15-12-5-2-1-3-6-12)11-16-9-4-7-14-8-10-16/h1-3,5-6,14H,4,7-11H2,(H,15,17)/p+1