2-(2-azanyl-3-propyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-azanyl-3-propyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-amino-3-propyl-1-benzimidazol-1-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(2-amino-3-propylbenzimidazol-1-ium-1-yl)-1-phenylethanone bromide Traditional Name: 2-(2-amino-3-propyl-benzimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide Formula: C18H20BrN3O MolecularWeight: 374.2749

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H19N3O.BrH/c1-2-12-20-15-10-6-7-11-16(15)21(18(20)19)13-17(22)14-8-4-3-5-9-14;/h3-11,19H,2,12-13H2,1H3;1H