5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-[3-(trifluoromethyl)phenoxy]furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-[3-(trifluoromethyl)phenoxy]furan-2-one Openeye Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-[3-(trifluoromethyl)phenoxy]furan-2-one CAS Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-[3-(trifluoromethyl)phenoxy]-2-furanone IUPAC Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-[3-(trifluoromethyl)phenoxy]furan-2-one Traditional Name: 4-(4-mesylphenyl)-5,5-dimethyl-3-[3-(trifluoromethyl)phenoxy]furan-2-one Formula: C20H17F3O5S MolecularWeight: 426.40619

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)OC2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)OC2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C20H17F3O5S/c1-19(2)16(12-7-9-15(10-8-12)29(3,25)26)17(18(24)28-19)27-14-6-4-5-13(11-14)20(21,22)23/h4-11H,1-3H3