5-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(3-chloro-4-hydroxy-5-methoxy-phenyl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-(3-chloro-4-hydroxy-5-methoxy-benzylidene)-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C14H13ClO6 MolecularWeight: 312.70242

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC2=CC(=C(C(=C2)Cl)O)OC)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CC2=CC(=C(C(=C2)Cl)O)OC)C(=O)O1)C

InChI

InChI=1S/C14H13ClO6/c1-14(2)20-12(17)8(13(18)21-14)4-7-5-9(15)11(16)10(6-7)19-3/h4-6,16H,1-3H3