4-(2-hydroxyphenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one

Systemtic Name: 4-(2-hydroxyphenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(2-hydroxyphenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(2-hydroxyphenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(2-hydroxyphenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 4-(2-hydroxyphenyl)-5-(4-mesylphenyl)-2,2-dimethyl-furan-3-one Formula: C19H18O5S MolecularWeight: 358.40822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3O)C

Isomeric SMILES

CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3O)C

InChI

InChI=1S/C19H18O5S/c1-19(2)18(21)16(14-6-4-5-7-15(14)20)17(24-19)12-8-10-13(11-9-12)25(3,22)23/h4-11,20H,1-3H3