3-methyl-2-[(2-methylphenyl)methylsulfonyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 3-methyl-2-[(2-methylphenyl)methylsulfonyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 3-methyl-2-(o-tolylmethylsulfonyl)-1-oxido-pyridin-1-ium CAS Name: 3-methyl-2-[(2-methylphenyl)methylsulfonyl]-1-oxidopyridin-1-ium IUPAC Name: 3-methyl-2-[(2-methylphenyl)methylsulfonyl]-1-oxidopyridin-1-ium Traditional Name: 3-methyl-2-(2-methylbenzyl)sulfonyl-1-oxido-pyridin-1-ium Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)[O-])S(=O)(=O)CC2=CC=CC=C2C

Isomeric SMILES

CC1=C([N+](=CC=C1)[O-])S(=O)(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C14H15NO3S/c1-11-6-3-4-8-13(11)10-19(17,18)14-12(2)7-5-9-15(14)16/h3-9H,10H2,1-2H3