2-(2-chloranyl-3-ethoxy-4-ethylsulfonyl-phenyl)carbonylcyclohexane-1,3-dione; cyclohexane-1,2-dione

Systemtic Name: 2-(2-chloranyl-3-ethoxy-4-ethylsulfonyl-phenyl)carbonylcyclohexane-1,3-dione; cyclohexane-1,2-dione Openeye Name: 2-(2-chloro-3-ethoxy-4-ethylsulfonyl-benzoyl)cyclohexane-1,3-dione; cyclohexane-1,2-dione CAS Name: 2-[(2-chloro-3-ethoxy-4-ethylsulfonylphenyl)-oxomethyl]cyclohexane-1,3-dione; cyclohexane-1,2-dione IUPAC Name: 2-(2-chloro-3-ethoxy-4-ethylsulfonylbenzoyl)cyclohexane-1,3-dione; cyclohexane-1,2-dione Traditional Name: 2-(2-chloro-4-esyl-3-ethoxy-benzoyl)cyclohexane-1,3-quinone; cyclohexane-1,2-quinone Formula: C23H27ClO8S MolecularWeight: 498.97368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1Cl)C(=O)C2C(=O)CCCC2=O)S(=O)(=O)CC.C1CCC(=O)C(=O)C1

Isomeric SMILES

CCOC1=C(C=CC(=C1Cl)C(=O)C2C(=O)CCCC2=O)S(=O)(=O)CC.C1CCC(=O)C(=O)C1

InChI

InChI=1S/C17H19ClO6S.C6H8O2/c1-3-24-17-13(25(22,23)4-2)9-8-10(15(17)18)16(21)14-11(19)6-5-7-12(14)20;7-5-3-1-2-4-6(5)8/h8-9,14H,3-7H2,1-2H3;1-4H2