methyl 2-(3-phenacylimidazol-3-ium-1-yl)ethanoate bromide

Systemtic Name: methyl 2-(3-phenacylimidazol-3-ium-1-yl)ethanoate bromide Openeye Name: methyl 2-(3-phenacylimidazol-3-ium-1-yl)acetate bromide CAS Name: 2-(3-phenacyl-1-imidazol-3-iumyl)acetic acid methyl ester bromide IUPAC Name: methyl 2-(3-phenacylimidazol-3-ium-1-yl)acetate bromide Traditional Name: 2-(3-phenacylimidazol-3-ium-1-yl)acetic acid methyl ester bromide Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=C[N+](=C1)CC(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

COC(=O)CN1C=C[N+](=C1)CC(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C14H15N2O3.BrH/c1-19-14(18)10-16-8-7-15(11-16)9-13(17)12-5-3-2-4-6-12;/h2-8,11H,9-10H2,1H3;1H/q+1;/p-1