5-(methylsulfonylmethyl)-2-[1-oxidanidyl-4-(trifluoromethyl)pyridin-1-ium-3-yl]-1,3-oxazole

Systemtic Name: 5-(methylsulfonylmethyl)-2-[1-oxidanidyl-4-(trifluoromethyl)pyridin-1-ium-3-yl]-1,3-oxazole Openeye Name: 5-(methylsulfonylmethyl)-2-[1-oxido-4-(trifluoromethyl)pyridin-1-ium-3-yl]oxazole CAS Name: 5-(methylsulfonylmethyl)-2-[1-oxido-4-(trifluoromethyl)-3-pyridin-1-iumyl]oxazole IUPAC Name: 5-(methylsulfonylmethyl)-2-[1-oxido-4-(trifluoromethyl)pyridin-1-ium-3-yl]-1,3-oxazole Traditional Name: 5-(mesylmethyl)-2-[1-oxido-4-(trifluoromethyl)pyridin-1-ium-3-yl]oxazole Formula: C11H9F3N2O4S MolecularWeight: 322.26037

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CN=C(O1)C2=C(C=C[N+](=C2)[O-])C(F)(F)F

Isomeric SMILES

CS(=O)(=O)CC1=CN=C(O1)C2=C(C=C[N+](=C2)[O-])C(F)(F)F

InChI

InChI=1S/C11H9F3N2O4S/c1-21(18,19)6-7-4-15-10(20-7)8-5-16(17)3-2-9(8)11(12,13)14/h2-5H,6H2,1H3