[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 2,6-dimethoxybenzoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 2,6-dimethoxybenzoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylene)-3-oxo-benzofuran-6-yl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid (3-keto-2-piperonylidene-coumaran-6-yl) ester Formula: C25H18O8 MolecularWeight: 446.40562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC5=C(C=C4)OCO5)O3

InChI

InChI=1S/C25H18O8/c1-28-18-4-3-5-19(29-2)23(18)25(27)32-15-7-8-16-20(12-15)33-22(24(16)26)11-14-6-9-17-21(10-14)31-13-30-17/h3-12H,13H2,1-2H3