1-(3-methoxyphenyl)-2-(3-propan-2-ylimidazol-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(3-methoxyphenyl)-2-(3-propan-2-ylimidazol-1-ium-1-yl)ethanone bromide Openeye Name: 2-(3-isopropylimidazol-1-ium-1-yl)-1-(3-methoxyphenyl)ethanone bromide CAS Name: 1-(3-methoxyphenyl)-2-(3-propan-2-yl-1-imidazol-1-iumyl)ethanone bromide IUPAC Name: 1-(3-methoxyphenyl)-2-(3-propan-2-ylimidazol-1-ium-1-yl)ethanone bromide Traditional Name: 2-(3-isopropylimidazol-1-ium-1-yl)-1-(3-methoxyphenyl)ethanone bromide Formula: C15H19BrN2O2 MolecularWeight: 339.22756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C[N+](=C1)CC(=O)C2=CC(=CC=C2)OC.[Br-]

Isomeric SMILES

CC(C)N1C=C[N+](=C1)CC(=O)C2=CC(=CC=C2)OC.[Br-]

InChI

InChI=1S/C15H19N2O2.BrH/c1-12(2)17-8-7-16(11-17)10-15(18)13-5-4-6-14(9-13)19-3;/h4-9,11-12H,10H2,1-3H3;1H/q+1;/p-1