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

Systemtic Name: [3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-keto-2-(3,4,5-trimethoxybenzylidene)coumaran-6-yl] ester Formula: C26H20O9 MolecularWeight: 476.4316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H20O9/c1-29-22-9-14(10-23(30-2)25(22)31-3)8-21-24(27)17-6-5-16(12-19(17)35-21)34-26(28)15-4-7-18-20(11-15)33-13-32-18/h4-12H,13H2,1-3H3