1-(4-pyridin-2-ylpyridin-1-ium-1-yl)undecan-1-ol bromide

Systemtic Name: 1-(4-pyridin-2-ylpyridin-1-ium-1-yl)undecan-1-ol bromide Openeye Name: 1-[4-(2-pyridyl)pyridin-1-ium-1-yl]undecan-1-ol bromide CAS Name: 1-[4-(2-pyridinyl)-1-pyridin-1-iumyl]-1-undecanol bromide IUPAC Name: 1-(4-pyridin-2-ylpyridin-1-ium-1-yl)undecan-1-ol bromide Traditional Name: 1-[4-(2-pyridyl)pyridin-1-ium-1-yl]undecan-1-ol bromide Formula: C21H31BrN2O MolecularWeight: 407.38764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC([N+]1=CC=C(C=C1)C2=CC=CC=N2)O.[Br-]

Isomeric SMILES

CCCCCCCCCCC([N+]1=CC=C(C=C1)C2=CC=CC=N2)O.[Br-]

InChI

InChI=1S/C21H31N2O.BrH/c1-2-3-4-5-6-7-8-9-13-21(24)23-17-14-19(15-18-23)20-12-10-11-16-22-20;/h10-12,14-18,21,24H,2-9,13H2,1H3;1H/q+1;/p-1