4-[2,4-bis(fluoranyl)phenyl]-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(2,4-difluorophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(2,4-difluorophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(2,4-difluorophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 4-(2,4-difluorophenyl)-5-(4-mesylphenyl)-2,2-dimethyl-furan-3-one Formula: C19H16F2O4S MolecularWeight: 378.389746

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=C(C=C(C=C3)F)F)C

Isomeric SMILES

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

InChI

InChI=1S/C19H16F2O4S/c1-19(2)18(22)16(14-9-6-12(20)10-15(14)21)17(25-19)11-4-7-13(8-5-11)26(3,23)24/h4-10H,1-3H3