4-(azepan-1-ium-1-yl)-N-(2-cyanophenyl)butanamide

Systemtic Name: 4-(azepan-1-ium-1-yl)-N-(2-cyanophenyl)butanamide Openeye Name: 4-(azepan-1-ium-1-yl)-N-(2-cyanophenyl)butanamide CAS Name: 4-(1-azepan-1-iumyl)-N-(2-cyanophenyl)butanamide IUPAC Name: 4-(azepan-1-ium-1-yl)-N-(2-cyanophenyl)butanamide Traditional Name: 4-(azepan-1-ium-1-yl)-N-(2-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=C2C#N

Isomeric SMILES

C1CCC[NH+](CC1)CCCC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C17H23N3O/c18-14-15-8-3-4-9-16(15)19-17(21)10-7-13-20-11-5-1-2-6-12-20/h3-4,8-9H,1-2,5-7,10-13H2,(H,19,21)/p+1