1-methyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium bromide iodide

Systemtic Name: 1-methyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium bromide iodide Openeye Name: 1-methyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium bromide iodide CAS Name: 1-methyl-4-(1-octyl-4-pyridin-1-iumyl)pyridin-1-ium bromide iodide IUPAC Name: 1-methyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium bromide iodide Traditional Name: 1-methyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium bromide iodide Formula: C19H28BrIN2 MolecularWeight: 491.24749

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.[Br-].[I-]

Isomeric SMILES

CCCCCCCC[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.[Br-].[I-]

InChI

InChI=1S/C19H28N2.BrH.HI/c1-3-4-5-6-7-8-13-21-16-11-19(12-17-21)18-9-14-20(2)15-10-18;;/h9-12,14-17H,3-8,13H2,1-2H3;2*1H/q+2;;/p-2