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1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide

1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide

Systemtic Name:1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide
Openeye Name:1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide
CAS Name:1-octyl-4-(1-octyl-4-pyridin-1-iumyl)pyridin-1-ium dibromide
IUPAC Name:1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide
Traditional Name:1-octyl-4-(1-octylpyridin-1-ium-4-yl)pyridin-1-ium dibromide
Formula: C26H42Br2N2
MolecularWeight: 542.43308
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C26H42N2.2BrH/c1-3-5-7-9-11-13-19-27-21-15-25(16-22-27)26-17-23-28(24-18-26)20-14-12-10-8-6-4-2;;/h15-18,21-24H,3-14,19-20H2,1-2H3;2*1H/q+2;;/p-2


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