5,5-dimethyl-3-[[4-(trifluoromethyl)pyridin-3-yl]methylsulfonyl]-4H-1,2-oxazole

Systemtic Name: 5,5-dimethyl-3-[[4-(trifluoromethyl)pyridin-3-yl]methylsulfonyl]-4H-1,2-oxazole Openeye Name: 5,5-dimethyl-3-[[4-(trifluoromethyl)-3-pyridyl]methylsulfonyl]-4H-isoxazole CAS Name: 5,5-dimethyl-3-[[4-(trifluoromethyl)-3-pyridinyl]methylsulfonyl]-4H-isoxazole IUPAC Name: 5,5-dimethyl-3-[[4-(trifluoromethyl)pyridin-3-yl]methylsulfonyl]-4H-1,2-oxazole Traditional Name: 5,5-dimethyl-3-[[4-(trifluoromethyl)-3-pyridyl]methylsulfonyl]-2-isoxazoline Formula: C12H13F3N2O3S MolecularWeight: 322.30343

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)S(=O)(=O)CC2=C(C=CN=C2)C(F)(F)F)C

Isomeric SMILES

CC1(CC(=NO1)S(=O)(=O)CC2=C(C=CN=C2)C(F)(F)F)C

InChI

InChI=1S/C12H13F3N2O3S/c1-11(2)5-10(17-20-11)21(18,19)7-8-6-16-4-3-9(8)12(13,14)15/h3-4,6H,5,7H2,1-2H3