N-(4-aminophenyl)-4-(azepan-1-ium-1-yl)butanamide

Systemtic Name: N-(4-aminophenyl)-4-(azepan-1-ium-1-yl)butanamide Openeye Name: N-(4-aminophenyl)-4-(azepan-1-ium-1-yl)butanamide CAS Name: N-(4-aminophenyl)-4-(1-azepan-1-iumyl)butanamide IUPAC Name: N-(4-aminophenyl)-4-(azepan-1-ium-1-yl)butanamide Traditional Name: N-(4-aminophenyl)-4-(azepan-1-ium-1-yl)butyramide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c17-14-7-9-15(10-8-14)18-16(20)6-5-13-19-11-3-1-2-4-12-19/h7-10H,1-6,11-13,17H2,(H,18,20)/p+1