[2-[(4-methoxycarbonylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[(4-methoxycarbonylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-[(4-methoxycarbonylphenyl)methylene]-3-oxo-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-[(4-methoxycarbonylphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-[(4-methoxycarbonylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-(4-carbomethoxybenzylidene)-3-keto-coumaran-6-yl] ester Formula: C25H16O8 MolecularWeight: 444.38974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H16O8/c1-29-24(27)15-4-2-14(3-5-15)10-22-23(26)18-8-7-17(12-20(18)33-22)32-25(28)16-6-9-19-21(11-16)31-13-30-19/h2-12H,13H2,1H3