3-pyridin-2-yl-1-[4-(3-pyridin-2-ylpyridin-1-ium-1-yl)butyl]pyridin-1-ium bromide

Systemtic Name: 3-pyridin-2-yl-1-[4-(3-pyridin-2-ylpyridin-1-ium-1-yl)butyl]pyridin-1-ium bromide Openeye Name: 3-(2-pyridyl)-1-[4-[3-(2-pyridyl)pyridin-1-ium-1-yl]butyl]pyridin-1-ium bromide CAS Name: 3-(2-pyridinyl)-1-[4-[3-(2-pyridinyl)-1-pyridin-1-iumyl]butyl]pyridin-1-ium bromide IUPAC Name: 3-pyridin-2-yl-1-[4-(3-pyridin-2-ylpyridin-1-ium-1-yl)butyl]pyridin-1-ium bromide Traditional Name: 3-(2-pyridyl)-1-[4-[3-(2-pyridyl)pyridin-1-ium-1-yl]butyl]pyridin-1-ium bromide Formula: C24H24BrN4+ MolecularWeight: 448.37816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=C[N+](=CC=C2)CCCC[N+]3=CC=CC(=C3)C4=CC=CC=N4.[Br-]

Isomeric SMILES

C1=CC=NC(=C1)C2=C[N+](=CC=C2)CCCC[N+]3=CC=CC(=C3)C4=CC=CC=N4.[Br-]

InChI

InChI=1S/C24H24N4.BrH/c1-3-13-25-23(11-1)21-9-7-17-27(19-21)15-5-6-16-28-18-8-10-22(20-28)24-12-2-4-14-26-24;/h1-4,7-14,17-20H,5-6,15-16H2;1H/q+2;/p-1