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

Systemtic Name: 4-(3-bromophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(3-bromophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(3-bromophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(3-bromophenyl)-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 4-(3-bromophenyl)-5-(4-mesylphenyl)-2,2-dimethyl-furan-3-one Formula: C19H17BrO4S MolecularWeight: 421.30488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrO4S/c1-19(2)18(21)16(13-5-4-6-14(20)11-13)17(24-19)12-7-9-15(10-8-12)25(3,22)23/h4-11H,1-3H3