5-(4-chlorophenyl)-2-(phenylsulfonylmethyl)cyclohexane-1,3-dione

Systemtic Name: 5-(4-chlorophenyl)-2-(phenylsulfonylmethyl)cyclohexane-1,3-dione Openeye Name: 2-(benzenesulfonylmethyl)-5-(4-chlorophenyl)cyclohexane-1,3-dione CAS Name: 2-(benzenesulfonylmethyl)-5-(4-chlorophenyl)cyclohexane-1,3-dione IUPAC Name: 2-(benzenesulfonylmethyl)-5-(4-chlorophenyl)cyclohexane-1,3-dione Traditional Name: 2-(besylmethyl)-5-(4-chlorophenyl)cyclohexane-1,3-quinone Formula: C19H17ClO4S MolecularWeight: 376.85388

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C(C1=O)CS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(CC(=O)C(C1=O)CS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClO4S/c20-15-8-6-13(7-9-15)14-10-18(21)17(19(22)11-14)12-25(23,24)16-4-2-1-3-5-16/h1-9,14,17H,10-12H2