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

Systemtic Name: 1-methyl-4-(phenylsulfonylmethyl)pyridin-1-ium Openeye Name: 4-(benzenesulfonylmethyl)-1-methyl-pyridin-1-ium CAS Name: 4-(benzenesulfonylmethyl)-1-methylpyridin-1-ium IUPAC Name: 4-(benzenesulfonylmethyl)-1-methylpyridin-1-ium Traditional Name: 4-(besylmethyl)-1-methyl-pyridin-1-ium Formula: C13H14NO2S+ MolecularWeight: 248.32076

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[N+]1=CC=C(C=C1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14NO2S/c1-14-9-7-12(8-10-14)11-17(15,16)13-5-3-2-4-6-13/h2-10H,11H2,1H3/q+1