2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-(2-azanyl-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(2-amino-3-ethyl-1-benzimidazol-1-iumyl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(2-amino-3-ethylbenzimidazol-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-(2-amino-3-ethyl-benzimidazol-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Formula: C18H20BrN3O2 MolecularWeight: 390.2743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CCN1C2=CC=CC=C2[N+](=C1N)CC(=O)C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C18H19N3O2.BrH/c1-3-20-15-6-4-5-7-16(15)21(18(20)19)12-17(22)13-8-10-14(23-2)11-9-13;/h4-11,19H,3,12H2,1-2H3;1H