2-(1-hexadecylpyridin-1-ium-4-yl)ethanol bromide

Systemtic Name: 2-(1-hexadecylpyridin-1-ium-4-yl)ethanol bromide Openeye Name: 2-(1-hexadecylpyridin-1-ium-4-yl)ethanol bromide CAS Name: 2-(1-hexadecyl-4-pyridin-1-iumyl)ethanol bromide IUPAC Name: 2-(1-hexadecylpyridin-1-ium-4-yl)ethanol bromide Traditional Name: 2-(1-cetylpyridin-1-ium-4-yl)ethanol bromide Formula: C23H42BrNO MolecularWeight: 428.48968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)CCO.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=C(C=C1)CCO.[Br-]

InChI

InChI=1S/C23H42NO.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-20-16-23(17-21-24)18-22-25;/h16-17,20-21,25H,2-15,18-19,22H2,1H3;1H/q+1;/p-1