1-methyl-2-[1-[2-(1-methylpyridin-1-ium-2-yl)ethyl]pyridin-1-ium-3-yl]pyridin-1-ium triiodide

Systemtic Name: 1-methyl-2-[1-[2-(1-methylpyridin-1-ium-2-yl)ethyl]pyridin-1-ium-3-yl]pyridin-1-ium triiodide Openeye Name: 1-methyl-2-[1-[2-(1-methylpyridin-1-ium-2-yl)ethyl]pyridin-1-ium-3-yl]pyridin-1-ium triiodide CAS Name: 1-methyl-2-[1-[2-(1-methyl-2-pyridin-1-iumyl)ethyl]-3-pyridin-1-iumyl]pyridin-1-ium triiodide IUPAC Name: 1-methyl-2-[1-[2-(1-methylpyridin-1-ium-2-yl)ethyl]pyridin-1-ium-3-yl]pyridin-1-ium triiodide Traditional Name: 1-methyl-2-[1-[2-(1-methylpyridin-1-ium-2-yl)ethyl]pyridin-1-ium-3-yl]pyridin-1-ium triiodide Formula: C19H22I3N3 MolecularWeight: 673.11149

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1CC[N+]2=CC=CC(=C2)C3=CC=CC=[N+]3C.[I-].[I-].[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1CC[N+]2=CC=CC(=C2)C3=CC=CC=[N+]3C.[I-].[I-].[I-]

InChI

InChI=1S/C19H22N3.3HI/c1-20-12-5-3-9-18(20)11-15-22-14-7-8-17(16-22)19-10-4-6-13-21(19)2;;;/h3-10,12-14,16H,11,15H2,1-2H3;3*1H/q+3;;;/p-3