5-[2,4-bis(fluoranyl)phenoxy]-3-ethenyl-2-methyl-6-(4-methylsulfonylphenyl)pyran-4-one

Systemtic Name: 5-[2,4-bis(fluoranyl)phenoxy]-3-ethenyl-2-methyl-6-(4-methylsulfonylphenyl)pyran-4-one Openeye Name: 5-(2,4-difluorophenoxy)-2-methyl-6-(4-methylsulfonylphenyl)-3-vinyl-pyran-4-one CAS Name: 5-(2,4-difluorophenoxy)-3-ethenyl-2-methyl-6-(4-methylsulfonylphenyl)-4-pyranone IUPAC Name: 5-(2,4-difluorophenoxy)-3-ethenyl-2-methyl-6-(4-methylsulfonylphenyl)pyran-4-one Traditional Name: 3-(2,4-difluorophenoxy)-2-(4-mesylphenyl)-6-methyl-5-vinyl-pyran-4-one Formula: C21H16F2O5S MolecularWeight: 418.410546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16F2O5S/c1-4-16-12(2)27-20(13-5-8-15(9-6-13)29(3,25)26)21(19(16)24)28-18-10-7-14(22)11-17(18)23/h4-11H,1H2,2-3H3