1-methyl-3-[4-(1-methylpyridin-1-ium-3-yl)buta-1,3-diynyl]pyridin-1-ium diiodide

Systemtic Name: 1-methyl-3-[4-(1-methylpyridin-1-ium-3-yl)buta-1,3-diynyl]pyridin-1-ium diiodide Openeye Name: 1-methyl-3-[4-(1-methylpyridin-1-ium-3-yl)buta-1,3-diynyl]pyridin-1-ium diiodide CAS Name: 1-methyl-3-[4-(1-methyl-3-pyridin-1-iumyl)buta-1,3-diynyl]pyridin-1-ium diiodide IUPAC Name: 1-methyl-3-[4-(1-methylpyridin-1-ium-3-yl)buta-1,3-diynyl]pyridin-1-ium diiodide Traditional Name: 1-methyl-3-[4-(1-methylpyridin-1-ium-3-yl)buta-1,3-diynyl]pyridin-1-ium diiodide Formula: C16H14I2N2 MolecularWeight: 488.1047

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C#CC#CC2=C[N+](=CC=C2)C.[I-].[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C#CC#CC2=C[N+](=CC=C2)C.[I-].[I-]

InChI

InChI=1S/C16H14N2.2HI/c1-17-11-5-9-15(13-17)7-3-4-8-16-10-6-12-18(2)14-16;;/h5-6,9-14H,1-2H3;2*1H/q+2;;/p-2