4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium diiodide

Systemtic Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium diiodide Openeye Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium diiodide CAS Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-yl-1-pyridin-1-iumyl)propyl]pyridin-1-ium diiodide IUPAC Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium diiodide Traditional Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium diiodide Formula: C23H22I2N4 MolecularWeight: 608.25652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=CC=[N+](C=C2)CCC[N+]3=CC=C(C=C3)C4=CC=NC=C4.[I-].[I-]

Isomeric SMILES

C1=CN=CC=C1C2=CC=[N+](C=C2)CCC[N+]3=CC=C(C=C3)C4=CC=NC=C4.[I-].[I-]

InChI

InChI=1S/C23H22N4.2HI/c1(14-26-16-6-22(7-17-26)20-2-10-24-11-3-20)15-27-18-8-23(9-19-27)21-4-12-25-13-5-21;;/h2-13,16-19H,1,14-15H2;2*1H/q+2;;/p-2