3-[3,4-bis(fluoranyl)phenoxy]-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one

Systemtic Name: 3-[3,4-bis(fluoranyl)phenoxy]-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one Openeye Name: 3-(3,4-difluorophenoxy)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one CAS Name: 3-(3,4-difluorophenoxy)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-2-furanone IUPAC Name: 3-(3,4-difluorophenoxy)-5-methyl-4-(4-methylsulfonylphenyl)-5-propylfuran-2-one Traditional Name: 3-(3,4-difluorophenoxy)-4-(4-mesylphenyl)-5-methyl-5-propyl-furan-2-one Formula: C21H20F2O5S MolecularWeight: 422.442306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=C(C(=O)O1)OC2=CC(=C(C=C2)F)F)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCCC1(C(=C(C(=O)O1)OC2=CC(=C(C=C2)F)F)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H20F2O5S/c1-4-11-21(2)18(13-5-8-15(9-6-13)29(3,25)26)19(20(24)28-21)27-14-7-10-16(22)17(23)12-14/h5-10,12H,4,11H2,1-3H3