1-[6-(3-oxidanylpyridin-1-ium-1-yl)hexyl]pyridin-1-ium-3-ol dibromide

Systemtic Name: 1-[6-(3-oxidanylpyridin-1-ium-1-yl)hexyl]pyridin-1-ium-3-ol dibromide Openeye Name: 1-[6-(3-hydroxypyridin-1-ium-1-yl)hexyl]pyridin-1-ium-3-ol dibromide CAS Name: 1-[6-(3-hydroxy-1-pyridin-1-iumyl)hexyl]-3-pyridin-1-iumol dibromide IUPAC Name: 1-[6-(3-hydroxypyridin-1-ium-1-yl)hexyl]pyridin-1-ium-3-ol dibromide Traditional Name: 1-[6-(3-hydroxypyridin-1-ium-1-yl)hexyl]pyridin-1-ium-3-ol dibromide Formula: C16H22Br2N2O2 MolecularWeight: 434.16608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CCCCCC[N+]2=CC=CC(=C2)O)O.[Br-].[Br-]

Isomeric SMILES

C1=CC(=C[N+](=C1)CCCCCC[N+]2=CC=CC(=C2)O)O.[Br-].[Br-]

InChI

InChI=1S/C16H20N2O2.2BrH/c19-15-7-5-11-17(13-15)9-3-1-2-4-10-18-12-6-8-16(20)14-18;;/h5-8,11-14H,1-4,9-10H2;2*1H