4-(4-fluorophenyl)-6-[(2-methylpropan-2-yl)oxy]-3-(4-methylsulfonylphenyl)pyran-2-one

Systemtic Name: 4-(4-fluorophenyl)-6-[(2-methylpropan-2-yl)oxy]-3-(4-methylsulfonylphenyl)pyran-2-one Openeye Name: 6-tert-butoxy-4-(4-fluorophenyl)-3-(4-methylsulfonylphenyl)pyran-2-one CAS Name: 4-(4-fluorophenyl)-6-[(2-methylpropan-2-yl)oxy]-3-(4-methylsulfonylphenyl)-2-pyranone IUPAC Name: 4-(4-fluorophenyl)-6-[(2-methylpropan-2-yl)oxy]-3-(4-methylsulfonylphenyl)pyran-2-one Traditional Name: 6-tert-butoxy-4-(4-fluorophenyl)-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)(C)OC1=CC(=C(C(=O)O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)OC1=CC(=C(C(=O)O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FO5S/c1-22(2,3)28-19-13-18(14-5-9-16(23)10-6-14)20(21(24)27-19)15-7-11-17(12-8-15)29(4,25)26/h5-13H,1-4H3