[(2Z)-6-acetyloxy-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-7-yl]methyl ethanoate

Systemtic Name: [(2Z)-6-acetyloxy-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-7-yl]methyl ethanoate Openeye Name: [(2Z)-6-acetoxy-2-(1,3-benzodioxol-5-ylmethylene)-3-oxo-benzofuran-7-yl]methyl acetate CAS Name: acetic acid [(2Z)-6-acetyloxy-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-7-benzofuranyl]methyl ester IUPAC Name: [(2Z)-6-acetyloxy-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-7-yl]methyl acetate Traditional Name: acetic acid [(2Z)-6-acetoxy-3-keto-2-piperonylidene-coumaran-7-yl]methyl ester Formula: C21H16O8 MolecularWeight: 396.34694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C=CC2=C1OC(=CC3=CC4=C(C=C3)OCO4)C2=O)OC(=O)C

Isomeric SMILES

CC(=O)OCC1=C(C=CC2=C1O/C(=C\C3=CC4=C(C=C3)OCO4)/C2=O)OC(=O)C

InChI

InChI=1S/C21H16O8/c1-11(22)25-9-15-16(28-12(2)23)6-4-14-20(24)19(29-21(14)15)8-13-3-5-17-18(7-13)27-10-26-17/h3-8H,9-10H2,1-2H3/b19-8-