2-[1-(2-methylphenyl)ethylsulfonyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[1-(2-methylphenyl)ethylsulfonyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[1-(o-tolyl)ethylsulfonyl]-1-oxido-pyridin-1-ium CAS Name: 2-[1-(2-methylphenyl)ethylsulfonyl]-1-oxidopyridin-1-ium IUPAC Name: 2-[1-(2-methylphenyl)ethylsulfonyl]-1-oxidopyridin-1-ium Traditional Name: 2-[1-(o-tolyl)ethylsulfonyl]-1-oxido-pyridin-1-ium Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)S(=O)(=O)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1=CC=CC=C1C(C)S(=O)(=O)C2=CC=CC=[N+]2[O-]

InChI

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