1-(dodecylsulfanylmethyl)pyridin-1-ium chloride

Systemtic Name: 1-(dodecylsulfanylmethyl)pyridin-1-ium chloride Openeye Name: 1-(dodecylsulfanylmethyl)pyridin-1-ium chloride CAS Name: 1-[(dodecylthio)methyl]pyridin-1-ium chloride IUPAC Name: 1-(dodecylsulfanylmethyl)pyridin-1-ium chloride Traditional Name: 1-[(laurylthio)methyl]pyridin-1-ium chloride Formula: C18H32ClNS MolecularWeight: 329.97138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC[N+]1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCSC[N+]1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C18H32NS.ClH/c1-2-3-4-5-6-7-8-9-10-14-17-20-18-19-15-12-11-13-16-19;/h11-13,15-16H,2-10,14,17-18H2,1H3;1H/q+1;/p-1