2-chloranyl-2-(4-methylsulfonylphenyl)carbonyl-cyclohexane-1,3-dione

Systemtic Name: 2-chloranyl-2-(4-methylsulfonylphenyl)carbonyl-cyclohexane-1,3-dione Openeye Name: 2-chloro-2-(4-methylsulfonylbenzoyl)cyclohexane-1,3-dione CAS Name: 2-chloro-2-[(4-methylsulfonylphenyl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-chloro-2-(4-methylsulfonylbenzoyl)cyclohexane-1,3-dione Traditional Name: 2-chloro-2-(4-mesylbenzoyl)cyclohexane-1,3-quinone Formula: C14H13ClO5S MolecularWeight: 328.76802

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2(C(=O)CCCC2=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2(C(=O)CCCC2=O)Cl

InChI

InChI=1S/C14H13ClO5S/c1-21(19,20)10-7-5-9(6-8-10)13(18)14(15)11(16)3-2-4-12(14)17/h5-8H,2-4H2,1H3