N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butanamide

Systemtic Name: N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butanamide Openeye Name: N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butanamide CAS Name: N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butanamide IUPAC Name: N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butanamide Traditional Name: N-(3-aminophenyl)-4-(4-methyl-1,4-diazepan-4-ium-1-yl)butyramide Formula: C16H27N4O+ MolecularWeight: 291.41178

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)CCCC(=O)NC2=CC=CC(=C2)N

Isomeric SMILES

C[NH+]1CCCN(CC1)CCCC(=O)NC2=CC=CC(=C2)N

InChI

InChI=1S/C16H26N4O/c1-19-8-4-10-20(12-11-19)9-3-7-16(21)18-15-6-2-5-14(17)13-15/h2,5-6,13H,3-4,7-12,17H2,1H3,(H,18,21)/p+1