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

Systemtic Name: 2-butyl-5-[(3-methoxy-2-oxidanyl-phenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione Openeye Name: 2-butyl-5-[(2-hydroxy-3-methoxy-phenyl)methylene]-2-methyl-1,3-dioxane-4,6-dione CAS Name: 2-butyl-5-[(2-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione IUPAC Name: 2-butyl-5-[(2-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione Traditional Name: 2-butyl-5-(2-hydroxy-3-methoxy-benzylidene)-2-methyl-1,3-dioxane-4,6-quinone Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC(=O)C(=CC2=C(C(=CC=C2)OC)O)C(=O)O1)C

Isomeric SMILES

CCCCC1(OC(=O)C(=CC2=C(C(=CC=C2)OC)O)C(=O)O1)C

InChI

InChI=1S/C17H20O6/c1-4-5-9-17(2)22-15(19)12(16(20)23-17)10-11-7-6-8-13(21-3)14(11)18/h6-8,10,18H,4-5,9H2,1-3H3