2-[4-[1-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-1-phenyl-ethanone dibromide

Systemtic Name: 2-[4-[1-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-1-phenyl-ethanone dibromide Openeye Name: 2-[4-[1-[2-oxo-2-(p-tolyl)ethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-1-phenyl-ethanone dibromide CAS Name: 2-[4-[1-[2-(4-methylphenyl)-2-oxoethyl]-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]-1-phenylethanone dibromide IUPAC Name: 2-[4-[1-[2-(4-methylphenyl)-2-oxoethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-1-phenylethanone dibromide Traditional Name: 2-[4-[1-[2-keto-2-(p-tolyl)ethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]-1-phenyl-ethanone dibromide Formula: C27H24Br2N2O2 MolecularWeight: 568.29966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC(=O)C4=CC=CC=C4.[Br-].[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC(=O)C4=CC=CC=C4.[Br-].[Br-]

InChI

InChI=1S/C27H24N2O2.2BrH/c1-21-7-9-25(10-8-21)27(31)20-29-17-13-23(14-18-29)22-11-15-28(16-12-22)19-26(30)24-5-3-2-4-6-24;;/h2-18H,19-20H2,1H3;2*1H/q+2;;/p-2