6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenoxy]pyran-4-one

Systemtic Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenoxy]pyran-4-one Openeye Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenoxy]pyran-4-one CAS Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenoxy]-4-pyranone IUPAC Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenoxy]pyran-4-one Traditional Name: 2-(4-mesylphenyl)-6-methyl-3-[4-(trifluoromethyl)phenoxy]pyran-4-one Formula: C20H15F3O5S MolecularWeight: 424.39031

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)OC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)OC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3O5S/c1-12-11-17(24)19(28-15-7-5-14(6-8-15)20(21,22)23)18(27-12)13-3-9-16(10-4-13)29(2,25)26/h3-11H,1-2H3