2-[6-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone

Systemtic Name: 2-[6-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone Openeye Name: 2-[6-[2-(4-bromophenyl)-2-oxo-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone CAS Name: 2-[6-[2-(4-bromophenyl)-2-oxoethyl]-1-methyl-2-pyridin-1-iumyl]-1-phenylethanone IUPAC Name: 2-[6-[2-(4-bromophenyl)-2-oxoethyl]-1-methylpyridin-1-ium-2-yl]-1-phenylethanone Traditional Name: 2-[6-[2-(4-bromophenyl)-2-keto-ethyl]-1-methyl-pyridin-1-ium-2-yl]-1-phenyl-ethanone Formula: C22H19BrNO2+ MolecularWeight: 409.29576

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC=C1CC(=O)C2=CC=C(C=C2)Br)CC(=O)C3=CC=CC=C3

Isomeric SMILES

C[N+]1=C(C=CC=C1CC(=O)C2=CC=C(C=C2)Br)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19BrNO2/c1-24-19(14-21(25)16-6-3-2-4-7-16)8-5-9-20(24)15-22(26)17-10-12-18(23)13-11-17/h2-13H,14-15H2,1H3/q+1