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

Systemtic Name: 2-[(3-fluorophenyl)methyl]-3-methylsulfonyl-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[(3-fluorophenyl)methyl]-3-methylsulfonyl-1-oxido-pyridin-1-ium CAS Name: 2-[(3-fluorophenyl)methyl]-3-methylsulfonyl-1-oxidopyridin-1-ium IUPAC Name: 2-[(3-fluorophenyl)methyl]-3-methylsulfonyl-1-oxidopyridin-1-ium Traditional Name: 2-(3-fluorobenzyl)-3-mesyl-1-oxido-pyridin-1-ium Formula: C13H12FNO3S MolecularWeight: 281.302683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12FNO3S/c1-19(17,18)13-6-3-7-15(16)12(13)9-10-4-2-5-11(14)8-10/h2-8H,9H2,1H3