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

Systemtic Name: 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxy-phenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione Openeye Name: 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxy-phenyl]methylene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione CAS Name: 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[[4-(1,3-benzodioxol-5-ylmethoxy)-3-methoxyphenyl]methylidene]-2-butyl-2-methyl-1,3-dioxane-4,6-dione Traditional Name: 2-butyl-5-(3-methoxy-4-piperonyloxy-benzylidene)-2-methyl-1,3-dioxane-4,6-quinone Formula: C25H26O8 MolecularWeight: 454.46914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC4=C(C=C3)OCO4)OC)C(=O)O1)C

Isomeric SMILES

CCCCC1(OC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC4=C(C=C3)OCO4)OC)C(=O)O1)C

InChI

InChI=1S/C25H26O8/c1-4-5-10-25(2)32-23(26)18(24(27)33-25)11-16-6-8-19(21(12-16)28-3)29-14-17-7-9-20-22(13-17)31-15-30-20/h6-9,11-13H,4-5,10,14-15H2,1-3H3