(3E)-4-(1,3-benzodioxol-5-ylcarbonyl)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one

Systemtic Name: (3E)-4-(1,3-benzodioxol-5-ylcarbonyl)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one Openeye Name: (3E)-4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4-dimethoxyphenyl)methylene]tetrahydrofuran-2-one CAS Name: (3E)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-3-[(3,4-dimethoxyphenyl)methylidene]-2-oxolanone IUPAC Name: (3E)-4-(1,3-benzodioxole-5-carbonyl)-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one Traditional Name: (3E)-4-piperonyloyl-3-veratrylidene-tetrahydrofuran-2-one Formula: C21H18O7 MolecularWeight: 382.36342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(COC2=O)C(=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\C(COC2=O)C(=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C21H18O7/c1-24-16-5-3-12(8-18(16)25-2)7-14-15(10-26-21(14)23)20(22)13-4-6-17-19(9-13)28-11-27-17/h3-9,15H,10-11H2,1-2H3/b14-7+