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

Systemtic Name: [2-[(2-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-(o-tolylmethylene)-3-oxo-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-[(2-methylphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-[(2-methylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-keto-2-(2-methylbenzylidene)coumaran-6-yl] ester Formula: C24H16O6 MolecularWeight: 400.38024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H16O6/c1-14-4-2-3-5-15(14)10-22-23(25)18-8-7-17(12-20(18)30-22)29-24(26)16-6-9-19-21(11-16)28-13-27-19/h2-12H,13H2,1H3