5-(3-chlorophenyl)-3,3-dimethyl-4-(4-methylsulfonylphenyl)-2H-pyran-6-one

Systemtic Name: 5-(3-chlorophenyl)-3,3-dimethyl-4-(4-methylsulfonylphenyl)-2H-pyran-6-one Openeye Name: 5-(3-chlorophenyl)-3,3-dimethyl-4-(4-methylsulfonylphenyl)-2H-pyran-6-one CAS Name: 5-(3-chlorophenyl)-3,3-dimethyl-4-(4-methylsulfonylphenyl)-2H-pyran-6-one IUPAC Name: 5-(3-chlorophenyl)-3,3-dimethyl-4-(4-methylsulfonylphenyl)-2H-pyran-6-one Traditional Name: 5-(3-chlorophenyl)-4-(4-mesylphenyl)-3,3-dimethyl-2H-pyran-6-one Formula: C20H19ClO4S MolecularWeight: 390.88046

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1(COC(=O)C(=C1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C20H19ClO4S/c1-20(2)12-25-19(22)17(14-5-4-6-15(21)11-14)18(20)13-7-9-16(10-8-13)26(3,23)24/h4-11H,12H2,1-3H3