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1-octyl-3-[6-[(1-octylpyridin-1-ium-3-yl)methoxy]hexoxymethyl]pyridin-1-ium dibromide
1-octyl-3-[6-[(1-octylpyridin-1-ium-3-yl)methoxy]hexoxymethyl]pyridin-1-ium dibromide
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCCCC[N+]1=CC=CC(=C1)COCCCCCCOCC2=C[N+](=CC=C2)CCCCCCCC.[Br-].[Br-]
Isomeric SMILES
CCCCCCCC[N+]1=CC=CC(=C1)COCCCCCCOCC2=C[N+](=CC=C2)CCCCCCCC.[Br-].[Br-]
InChI
InChI=1S/C34H58N2O2.2BrH/c1-3-5-7-9-11-15-23-35-25-19-21-33(29-35)31-37-27-17-13-14-18-28-38-32-34-22-20-26-36(30-34)24-16-12-10-8-6-4-2;;/h19-22,25-26,29-30H,3-18,23-24,27-28,31-32H2,1-2H3;2*1H/q+2;;/p-2
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