5,5-dimethyl-4-(2-methyl-4-methylsulfonyl-phenyl)-3-(4-methylphenyl)furan-2-one

Systemtic Name: 5,5-dimethyl-4-(2-methyl-4-methylsulfonyl-phenyl)-3-(4-methylphenyl)furan-2-one Openeye Name: 5,5-dimethyl-4-(2-methyl-4-methylsulfonyl-phenyl)-3-(p-tolyl)furan-2-one CAS Name: 5,5-dimethyl-4-(2-methyl-4-methylsulfonylphenyl)-3-(4-methylphenyl)-2-furanone IUPAC Name: 5,5-dimethyl-4-(2-methyl-4-methylsulfonylphenyl)-3-(4-methylphenyl)furan-2-one Traditional Name: 4-(4-mesyl-2-methyl-phenyl)-5,5-dimethyl-3-(p-tolyl)furan-2-one Formula: C21H22O4S MolecularWeight: 370.46198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(OC2=O)(C)C)C3=C(C=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(OC2=O)(C)C)C3=C(C=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H22O4S/c1-13-6-8-15(9-7-13)18-19(21(3,4)25-20(18)22)17-11-10-16(12-14(17)2)26(5,23)24/h6-12H,1-5H3