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

Systemtic Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]pyran-4-one Openeye Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]pyran-4-one CAS Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]-4-pyranone IUPAC Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-[4-(trifluoromethyl)phenyl]pyran-4-one Traditional Name: 2-(4-mesylphenyl)-6-methyl-3-[4-(trifluoromethyl)phenyl]pyran-4-one Formula: C20H15F3O4S MolecularWeight: 408.39091

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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)C3=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)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H15F3O4S/c1-12-11-17(24)18(13-3-7-15(8-4-13)20(21,22)23)19(27-12)14-5-9-16(10-6-14)28(2,25)26/h3-11H,1-2H3