4-(azepan-1-ium-1-yl)-N-(3-cyanophenyl)butanamide

Systemtic Name: 4-(azepan-1-ium-1-yl)-N-(3-cyanophenyl)butanamide Openeye Name: 4-(azepan-1-ium-1-yl)-N-(3-cyanophenyl)butanamide CAS Name: 4-(1-azepan-1-iumyl)-N-(3-cyanophenyl)butanamide IUPAC Name: 4-(azepan-1-ium-1-yl)-N-(3-cyanophenyl)butanamide Traditional Name: 4-(azepan-1-ium-1-yl)-N-(3-cyanophenyl)butyramide Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CCC[NH+](CC1)CCCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H23N3O/c18-14-15-7-5-8-16(13-15)19-17(21)9-6-12-20-10-3-1-2-4-11-20/h5,7-8,13H,1-4,6,9-12H2,(H,19,21)/p+1