3-methylsulfonyl-1-oxidanidyl-2-(phenylmethyl)pyridin-1-ium

Systemtic Name: 3-methylsulfonyl-1-oxidanidyl-2-(phenylmethyl)pyridin-1-ium Openeye Name: 2-benzyl-3-methylsulfonyl-1-oxido-pyridin-1-ium CAS Name: 3-methylsulfonyl-1-oxido-2-(phenylmethyl)pyridin-1-ium IUPAC Name: 2-benzyl-3-methylsulfonyl-1-oxidopyridin-1-ium Traditional Name: 2-benzyl-3-mesyl-1-oxido-pyridin-1-ium Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C([N+](=CC=C1)[O-])CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=C([N+](=CC=C1)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C13H13NO3S/c1-18(16,17)13-8-5-9-14(15)12(13)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3