1-(3-hexadecoxypropyl)pyridin-1-ium bromide

Systemtic Name: 1-(3-hexadecoxypropyl)pyridin-1-ium bromide Openeye Name: 1-(3-hexadecoxypropyl)pyridin-1-ium bromide CAS Name: 1-(3-hexadecoxypropyl)pyridin-1-ium bromide IUPAC Name: 1-(3-hexadecoxypropyl)pyridin-1-ium bromide Traditional Name: 1-(3-cetyloxypropyl)pyridin-1-ium bromide Formula: C24H44BrNO MolecularWeight: 442.51626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCC[N+]1=CC=CC=C1.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCC[N+]1=CC=CC=C1.[Br-]

InChI

InChI=1S/C24H44NO.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-26-24-19-22-25-20-16-15-17-21-25;/h15-17,20-21H,2-14,18-19,22-24H2,1H3;1H/q+1;/p-1