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

Systemtic Name: 1-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)propan-2-one bromide Openeye Name: 1-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)propan-2-one bromide CAS Name: 1-(2-amino-3-ethyl-1-benzimidazol-1-iumyl)-2-propanone bromide IUPAC Name: 1-(2-amino-3-ethylbenzimidazol-1-ium-1-yl)propan-2-one bromide Traditional Name: 1-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)acetone bromide Formula: C12H16BrN3O MolecularWeight: 298.17894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C.[Br-]

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C.[Br-]

InChI

InChI=1S/C12H15N3O.BrH/c1-3-14-10-6-4-5-7-11(10)15(12(14)13)8-9(2)16;/h4-7,13H,3,8H2,1-2H3;1H