4-(4-fluorophenyl)-6-(2-methylpropoxy)-3-(4-methylsulfonylphenyl)pyran-2-one

Systemtic Name: 4-(4-fluorophenyl)-6-(2-methylpropoxy)-3-(4-methylsulfonylphenyl)pyran-2-one Openeye Name: 4-(4-fluorophenyl)-6-isobutoxy-3-(4-methylsulfonylphenyl)pyran-2-one CAS Name: 4-(4-fluorophenyl)-6-(2-methylpropoxy)-3-(4-methylsulfonylphenyl)-2-pyranone IUPAC Name: 4-(4-fluorophenyl)-6-(2-methylpropoxy)-3-(4-methylsulfonylphenyl)pyran-2-one Traditional Name: 4-(4-fluorophenyl)-6-isobutoxy-3-(4-mesylphenyl)pyran-2-one Formula: C22H21FO5S MolecularWeight: 416.462543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=C(C(=O)O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)COC1=CC(=C(C(=O)O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FO5S/c1-14(2)13-27-20-12-19(15-4-8-17(23)9-5-15)21(22(24)28-20)16-6-10-18(11-7-16)29(3,25)26/h4-12,14H,13H2,1-3H3