1-(2-azanyl-3-propyl-benzimidazol-1-ium-1-yl)propan-2-one bromide

Systemtic Name: 1-(2-azanyl-3-propyl-benzimidazol-1-ium-1-yl)propan-2-one bromide Openeye Name: 1-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)propan-2-one bromide CAS Name: 1-(2-amino-3-propyl-1-benzimidazol-1-iumyl)-2-propanone bromide IUPAC Name: 1-(2-amino-3-propylbenzimidazol-1-ium-1-yl)propan-2-one bromide Traditional Name: 1-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)acetone bromide Formula: C13H18BrN3O MolecularWeight: 312.20552

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C.[Br-]

Isomeric SMILES

CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C.[Br-]

InChI

InChI=1S/C13H17N3O.BrH/c1-3-8-15-11-6-4-5-7-12(11)16(13(15)14)9-10(2)17;/h4-7,14H,3,8-9H2,1-2H3;1H