1-hexadecyl-2-methyl-pyridin-1-ium chloride

Systemtic Name: 1-hexadecyl-2-methyl-pyridin-1-ium chloride Openeye Name: 1-hexadecyl-2-methyl-pyridin-1-ium chloride CAS Name: 1-hexadecyl-2-methylpyridin-1-ium chloride IUPAC Name: 1-hexadecyl-2-methylpyridin-1-ium chloride Traditional Name: 1-cetyl-2-methyl-pyridin-1-ium chloride Formula: C22H40ClN MolecularWeight: 354.0127

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1C.[Cl-]

InChI

InChI=1S/C22H40N.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-21-18-16-19-22(23)2;/h16,18-19,21H,3-15,17,20H2,1-2H3;1H/q+1;/p-1