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

Systemtic Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium dibromide Openeye Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium dibromide CAS Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-yl-1-pyridin-1-iumyl)propyl]pyridin-1-ium dibromide IUPAC Name: 4-pyridin-4-yl-1-[3-(4-pyridin-4-ylpyridin-1-ium-1-yl)propyl]pyridin-1-ium dibromide Traditional Name: 4-(4-pyridyl)-1-[3-[4-(4-pyridyl)pyridin-1-ium-1-yl]propyl]pyridin-1-ium dibromide Formula: C23H22Br2N4 MolecularWeight: 514.25558

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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.[Br-].[Br-]

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4.2BrH/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