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

Systemtic Name: [3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-[(4-isopropylphenyl)methylene]-3-oxo-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-(4-isopropylbenzylidene)-3-keto-coumaran-6-yl] ester Formula: C26H20O6 MolecularWeight: 428.4334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)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

CC(C)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/C26H20O6/c1-15(2)17-5-3-16(4-6-17)11-24-25(27)20-9-8-19(13-22(20)32-24)31-26(28)18-7-10-21-23(12-18)30-14-29-21/h3-13,15H,14H2,1-2H3