2-(3-butan-2-ylimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(3-butan-2-ylimidazol-1-ium-1-yl)-1-phenyl-ethanone bromide Openeye Name: 1-phenyl-2-(3-sec-butylimidazol-1-ium-1-yl)ethanone bromide CAS Name: 2-(3-butan-2-yl-1-imidazol-1-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(3-butan-2-ylimidazol-1-ium-1-yl)-1-phenylethanone bromide Traditional Name: 1-phenyl-2-(3-sec-butylimidazol-1-ium-1-yl)ethanone bromide Formula: C15H19BrN2O MolecularWeight: 323.22816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N2O.BrH/c1-3-13(2)17-10-9-16(12-17)11-15(18)14-7-5-4-6-8-14;/h4-10,12-13H,3,11H2,1-2H3;1H/q+1;/p-1