1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium

Systemtic Name: 1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium Openeye Name: 1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium CAS Name: 1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium IUPAC Name: 1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium Traditional Name: 1-methyl-4-(2-octylsulfonylethyl)pyridin-1-ium Formula: C16H28NO2S+ MolecularWeight: 298.46402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)CCC1=CC=[N+](C=C1)C

Isomeric SMILES

CCCCCCCCS(=O)(=O)CCC1=CC=[N+](C=C1)C

InChI

InChI=1S/C16H28NO2S/c1-3-4-5-6-7-8-14-20(18,19)15-11-16-9-12-17(2)13-10-16/h9-10,12-13H,3-8,11,14-15H2,1-2H3/q+1