1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium chloride

Systemtic Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium chloride Openeye Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium chloride CAS Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium chloride IUPAC Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium chloride Traditional Name: 4-(mesylmethyl)-1-methyl-pyridin-1-ium chloride Formula: C8H12ClNO2S MolecularWeight: 221.70438

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)CS(=O)(=O)C.[Cl-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)CS(=O)(=O)C.[Cl-]

InChI

InChI=1S/C8H12NO2S.ClH/c1-9-5-3-8(4-6-9)7-12(2,10)11;/h3-6H,7H2,1-2H3;1H/q+1;/p-1