2-[2-[3,4-bis(fluoranyl)phenyl]-3-methyl-imidazol-3-ium-1-yl]ethanal bromide

Systemtic Name: 2-[2-[3,4-bis(fluoranyl)phenyl]-3-methyl-imidazol-3-ium-1-yl]ethanal bromide Openeye Name: 2-[2-(3,4-difluorophenyl)-3-methyl-imidazol-3-ium-1-yl]acetaldehyde bromide CAS Name: 2-[2-(3,4-difluorophenyl)-3-methyl-1-imidazol-3-iumyl]acetaldehyde bromide IUPAC Name: 2-[2-(3,4-difluorophenyl)-3-methylimidazol-3-ium-1-yl]acetaldehyde bromide Traditional Name: 2-[2-(3,4-difluorophenyl)-3-methyl-imidazol-3-ium-1-yl]acetaldehyde bromide Formula: C12H11BrF2N2O MolecularWeight: 317.129346

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C=C1)CC=O)C2=CC(=C(C=C2)F)F.[Br-]

Isomeric SMILES

C[N+]1=C(N(C=C1)CC=O)C2=CC(=C(C=C2)F)F.[Br-]

InChI

InChI=1S/C12H11F2N2O.BrH/c1-15-4-5-16(6-7-17)12(15)9-2-3-10(13)11(14)8-9;/h2-5,7-8H,6H2,1H3;1H/q+1;/p-1