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

Systemtic Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium Openeye Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium CAS Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium IUPAC Name: 1-methyl-4-(methylsulfonylmethyl)pyridin-1-ium Traditional Name: 4-(mesylmethyl)-1-methyl-pyridin-1-ium Formula: C8H12NO2S+ MolecularWeight: 186.25138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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