1-[5-(3-oxidanylpyridin-1-ium-1-yl)pentyl]pyridin-1-ium-3-ol bromide

Systemtic Name: 1-[5-(3-oxidanylpyridin-1-ium-1-yl)pentyl]pyridin-1-ium-3-ol bromide Openeye Name: 1-[5-(3-hydroxypyridin-1-ium-1-yl)pentyl]pyridin-1-ium-3-ol bromide CAS Name: 1-[5-(3-hydroxy-1-pyridin-1-iumyl)pentyl]-3-pyridin-1-iumol bromide IUPAC Name: 1-[5-(3-hydroxypyridin-1-ium-1-yl)pentyl]pyridin-1-ium-3-ol bromide Traditional Name: 1-[5-(3-hydroxypyridin-1-ium-1-yl)pentyl]pyridin-1-ium-3-ol bromide Formula: C15H20BrN2O2+ MolecularWeight: 340.2355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O2.BrH/c18-14-6-4-10-16(12-14)8-2-1-3-9-17-11-5-7-15(19)13-17;/h4-7,10-13H,1-3,8-9H2;1H/p+1