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

Systemtic Name: N-(2-aminophenyl)-2-(azepan-1-ium-1-yl)ethanamide Openeye Name: N-(2-aminophenyl)-2-(azepan-1-ium-1-yl)acetamide CAS Name: N-(2-aminophenyl)-2-(1-azepan-1-iumyl)acetamide IUPAC Name: N-(2-aminophenyl)-2-(azepan-1-ium-1-yl)acetamide Traditional Name: N-(2-aminophenyl)-2-(azepan-1-ium-1-yl)acetamide Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NC2=CC=CC=C2N

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NC2=CC=CC=C2N

InChI

InChI=1S/C14H21N3O/c15-12-7-3-4-8-13(12)16-14(18)11-17-9-5-1-2-6-10-17/h3-4,7-8H,1-2,5-6,9-11,15H2,(H,16,18)/p+1