2-(2-chloranyl-3-ethoxy-4-methylsulfonyl-phenyl)carbonylcyclohexane-1,3-dione

Systemtic Name: 2-(2-chloranyl-3-ethoxy-4-methylsulfonyl-phenyl)carbonylcyclohexane-1,3-dione Openeye Name: 2-(2-chloro-3-ethoxy-4-methylsulfonyl-benzoyl)cyclohexane-1,3-dione CAS Name: 2-[(2-chloro-3-ethoxy-4-methylsulfonylphenyl)-oxomethyl]cyclohexane-1,3-dione IUPAC Name: 2-(2-chloro-3-ethoxy-4-methylsulfonylbenzoyl)cyclohexane-1,3-dione Traditional Name: 2-(2-chloro-3-ethoxy-4-mesyl-benzoyl)cyclohexane-1,3-quinone Formula: C16H17ClO6S MolecularWeight: 372.82058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1Cl)C(=O)C2C(=O)CCCC2=O)S(=O)(=O)C

Isomeric SMILES

CCOC1=C(C=CC(=C1Cl)C(=O)C2C(=O)CCCC2=O)S(=O)(=O)C

InChI

InChI=1S/C16H17ClO6S/c1-3-23-16-12(24(2,21)22)8-7-9(14(16)17)15(20)13-10(18)5-4-6-11(13)19/h7-8,13H,3-6H2,1-2H3