6-methyl-2-(4-methylsulfonylphenyl)-3-propan-2-yl-pyran-4-one

Systemtic Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-propan-2-yl-pyran-4-one Openeye Name: 3-isopropyl-6-methyl-2-(4-methylsulfonylphenyl)pyran-4-one CAS Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-propan-2-yl-4-pyranone IUPAC Name: 6-methyl-2-(4-methylsulfonylphenyl)-3-propan-2-ylpyran-4-one Traditional Name: 3-isopropyl-2-(4-mesylphenyl)-6-methyl-pyran-4-one Formula: C16H18O4S MolecularWeight: 306.37672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O4S/c1-10(2)15-14(17)9-11(3)20-16(15)12-5-7-13(8-6-12)21(4,18)19/h5-10H,1-4H3