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

Systemtic Name: 2,2-dimethyl-4-(3-methylphenyl)-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 2,2-dimethyl-5-(4-methylsulfonylphenyl)-4-(m-tolyl)furan-3-one CAS Name: 2,2-dimethyl-4-(3-methylphenyl)-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 2,2-dimethyl-4-(3-methylphenyl)-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 5-(4-mesylphenyl)-2,2-dimethyl-4-(m-tolyl)furan-3-one Formula: C20H20O4S MolecularWeight: 356.4354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H20O4S/c1-13-6-5-7-15(12-13)17-18(24-20(2,3)19(17)21)14-8-10-16(11-9-14)25(4,22)23/h5-12H,1-4H3