1-(dodecylsulfanylmethyl)-3,5-dimethyl-pyridin-1-ium

Systemtic Name: 1-(dodecylsulfanylmethyl)-3,5-dimethyl-pyridin-1-ium Openeye Name: 1-(dodecylsulfanylmethyl)-3,5-dimethyl-pyridin-1-ium CAS Name: 1-[(dodecylthio)methyl]-3,5-dimethylpyridin-1-ium IUPAC Name: 1-(dodecylsulfanylmethyl)-3,5-dimethylpyridin-1-ium Traditional Name: 1-[(laurylthio)methyl]-3,5-dimethyl-pyridin-1-ium Formula: C20H36NS+ MolecularWeight: 322.57154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC[N+]1=CC(=CC(=C1)C)C

Isomeric SMILES

CCCCCCCCCCCCSC[N+]1=CC(=CC(=C1)C)C

InChI

InChI=1S/C20H36NS/c1-4-5-6-7-8-9-10-11-12-13-14-22-18-21-16-19(2)15-20(3)17-21/h15-17H,4-14,18H2,1-3H3/q+1