1-methyl-2-[3-(1-methylpyridin-1-ium-2-yl)azulen-1-yl]pyridin-1-ium diiodide

Systemtic Name: 1-methyl-2-[3-(1-methylpyridin-1-ium-2-yl)azulen-1-yl]pyridin-1-ium diiodide Openeye Name: 1-methyl-2-[3-(1-methylpyridin-1-ium-2-yl)azulen-1-yl]pyridin-1-ium diiodide CAS Name: 1-methyl-2-[3-(1-methyl-2-pyridin-1-iumyl)-1-azulenyl]pyridin-1-ium diiodide IUPAC Name: 1-methyl-2-[3-(1-methylpyridin-1-ium-2-yl)azulen-1-yl]pyridin-1-ium diiodide Traditional Name: 1-methyl-2-[3-(1-methylpyridin-1-ium-2-yl)azulen-1-yl]pyridin-1-ium diiodide Formula: C22H20I2N2 MolecularWeight: 566.21654

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1C2=CC(=C3C2=CC=CC=C3)C4=CC=CC=[N+]4C.[I-].[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1C2=CC(=C3C2=CC=CC=C3)C4=CC=CC=[N+]4C.[I-].[I-]

InChI

InChI=1S/C22H20N2.2HI/c1-23-14-8-6-12-21(23)19-16-20(22-13-7-9-15-24(22)2)18-11-5-3-4-10-17(18)19;;/h3-16H,1-2H3;2*1H/q+2;;/p-2