1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide

Systemtic Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide Openeye Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide CAS Name: 1-(1-methyl-3-pyridin-1-iumyl)-3-(1-methyl-4-pyridin-1-iumyl)urea diiodide IUPAC Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide Traditional Name: 1-(1-methylpyridin-1-ium-3-yl)-3-(1-methylpyridin-1-ium-4-yl)urea diiodide Formula: C13H16I2N4O MolecularWeight: 498.10128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)NC(=O)NC2=C[N+](=CC=C2)C.[I-].[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)NC(=O)NC2=C[N+](=CC=C2)C.[I-].[I-]

InChI

InChI=1S/C13H14N4O.2HI/c1-16-8-5-11(6-9-16)14-13(18)15-12-4-3-7-17(2)10-12;;/h3-10H,1-2H3;2*1H