1-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)butan-2-one bromide

Systemtic Name: 1-(2-azanyl-3-butyl-benzimidazol-1-ium-1-yl)butan-2-one bromide Openeye Name: 1-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)butan-2-one bromide CAS Name: 1-(2-amino-3-butyl-1-benzimidazol-1-iumyl)-2-butanone bromide IUPAC Name: 1-(2-amino-3-butylbenzimidazol-1-ium-1-yl)butan-2-one bromide Traditional Name: 1-(2-amino-3-butyl-benzimidazol-1-ium-1-yl)butan-2-one bromide Formula: C15H22BrN3O MolecularWeight: 340.25868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)CC.[Br-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)CC.[Br-]

InChI

InChI=1S/C15H21N3O.BrH/c1-3-5-10-17-13-8-6-7-9-14(13)18(15(17)16)11-12(19)4-2;/h6-9,16H,3-5,10-11H2,1-2H3;1H