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

Systemtic Name: 4-[3,5-bis(fluoranyl)phenyl]-5-(3-bromanyl-4-methylsulfinyl-phenyl)-2,2-dimethyl-furan-3-one Openeye Name: 5-(3-bromo-4-methylsulfinyl-phenyl)-4-(3,5-difluorophenyl)-2,2-dimethyl-furan-3-one CAS Name: 5-(3-bromo-4-methylsulfinylphenyl)-4-(3,5-difluorophenyl)-2,2-dimethyl-3-furanone IUPAC Name: 5-(3-bromo-4-methylsulfinylphenyl)-4-(3,5-difluorophenyl)-2,2-dimethylfuran-3-one Traditional Name: 5-(3-bromo-4-methylsulfinyl-phenyl)-4-(3,5-difluorophenyl)-2,2-dimethyl-furan-3-one Formula: C19H15BrF2O3S MolecularWeight: 441.286406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrF2O3S/c1-19(2)18(23)16(11-6-12(21)9-13(22)7-11)17(25-19)10-4-5-15(26(3)24)14(20)8-10/h4-9H,1-3H3