5-cyclopropyl-4-[5-methylsulfonyl-3-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]-1,2-oxazole

Systemtic Name: 5-cyclopropyl-4-[5-methylsulfonyl-3-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]-1,2-oxazole Openeye Name: 5-cyclopropyl-4-[5-methylsulfonyl-3-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]isoxazole CAS Name: 5-cyclopropyl-4-[5-methylsulfonyl-3-(trifluoromethyl)-1-cyclohexa-2,4-dienyl]isoxazole IUPAC Name: 5-cyclopropyl-4-[5-methylsulfonyl-3-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]-1,2-oxazole Traditional Name: 5-cyclopropyl-4-[5-mesyl-3-(trifluoromethyl)cyclohexa-2,4-dien-1-yl]isoxazole Formula: C14H14F3NO3S MolecularWeight: 333.32607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC(C1)C2=C(ON=C2)C3CC3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC(C1)C2=C(ON=C2)C3CC3)C(F)(F)F

InChI

InChI=1S/C14H14F3NO3S/c1-22(19,20)11-5-9(4-10(6-11)14(15,16)17)12-7-18-21-13(12)8-2-3-8/h4,6-9H,2-3,5H2,1H3