5-methyl-2-[(8-methylsulfonylquinolin-5-yl)-oxidanyl-methylidene]cyclohexane-1,3-dione

Systemtic Name: 5-methyl-2-[(8-methylsulfonylquinolin-5-yl)-oxidanyl-methylidene]cyclohexane-1,3-dione Openeye Name: 2-[hydroxy-(8-methylsulfonyl-5-quinolyl)methylene]-5-methyl-cyclohexane-1,3-dione CAS Name: 2-[hydroxy-(8-methylsulfonyl-5-quinolinyl)methylidene]-5-methylcyclohexane-1,3-dione IUPAC Name: 2-[hydroxy-(8-methylsulfonylquinolin-5-yl)methylidene]-5-methylcyclohexane-1,3-dione Traditional Name: 2-[hydroxy-(8-mesyl-5-quinolyl)methylene]-5-methyl-cyclohexane-1,3-quinone Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(=C(C2=C3C=CC=NC3=C(C=C2)S(=O)(=O)C)O)C(=O)C1

Isomeric SMILES

CC1CC(=O)C(=C(C2=C3C=CC=NC3=C(C=C2)S(=O)(=O)C)O)C(=O)C1

InChI

InChI=1S/C18H17NO5S/c1-10-8-13(20)16(14(21)9-10)18(22)12-5-6-15(25(2,23)24)17-11(12)4-3-7-19-17/h3-7,10,22H,8-9H2,1-2H3