[2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-(1H-indol-3-ylmethylene)-3-oxo-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-(1H-indol-3-ylmethylidene)-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-(1H-indol-3-ylmethylidene)-3-oxo-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-(1H-indol-3-ylmethylene)-3-keto-coumaran-6-yl] ester Formula: C25H15NO6 MolecularWeight: 425.3897

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CNC6=CC=CC=C65)O4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CNC6=CC=CC=C65)O4

InChI

InChI=1S/C25H15NO6/c27-24-18-7-6-16(31-25(28)14-5-8-20-22(9-14)30-13-29-20)11-21(18)32-23(24)10-15-12-26-19-4-2-1-3-17(15)19/h1-12,26H,13H2