2-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-(3-ethyloctan-3-yl)-1,3-dioxane-4,6-dione

Systemtic Name: 2-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-(3-ethyloctan-3-yl)-1,3-dioxane-4,6-dione Openeye Name: 5-(1,1-diethylhexyl)-2-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3-dioxane-4,6-dione CAS Name: 5-(3-ethyloctan-3-yl)-2-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dioxane-4,6-dione IUPAC Name: 5-(3-ethyloctan-3-yl)-2-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-dioxane-4,6-dione Traditional Name: 5-(1,1-diethylhexyl)-2-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3-dioxane-4,6-quinone Formula: C22H32O7 MolecularWeight: 408.48528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(CC)C1C(=O)OC(OC1=O)C2=CC(=C(C(=C2)OC)O)OC

Isomeric SMILES

CCCCCC(CC)(CC)C1C(=O)OC(OC1=O)C2=CC(=C(C(=C2)OC)O)OC

InChI

InChI=1S/C22H32O7/c1-6-9-10-11-22(7-2,8-3)17-19(24)28-21(29-20(17)25)14-12-15(26-4)18(23)16(13-14)27-5/h12-13,17,21,23H,6-11H2,1-5H3