6-methyl-3-(3-methylphenyl)-2-(4-methylsulfonylphenyl)pyran-4-one

Systemtic Name: 6-methyl-3-(3-methylphenyl)-2-(4-methylsulfonylphenyl)pyran-4-one Openeye Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-(m-tolyl)pyran-4-one CAS Name: 6-methyl-3-(3-methylphenyl)-2-(4-methylsulfonylphenyl)-4-pyranone IUPAC Name: 6-methyl-3-(3-methylphenyl)-2-(4-methylsulfonylphenyl)pyran-4-one Traditional Name: 2-(4-mesylphenyl)-6-methyl-3-(m-tolyl)pyran-4-one Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(OC(=CC2=O)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(OC(=CC2=O)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H18O4S/c1-13-5-4-6-16(11-13)19-18(21)12-14(2)24-20(19)15-7-9-17(10-8-15)25(3,22)23/h4-12H,1-3H3