2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoic acid

Systemtic Name: 2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-ylmethylene)-3-oxo-benzofuran-6-yl]oxypropanoic acid CAS Name: 2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-6-benzofuranyl]oxy]propanoic acid IUPAC Name: 2-[[2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]propanoic acid Traditional Name: 2-(3-keto-2-piperonylidene-coumaran-6-yl)oxypropionic acid Formula: C19H14O7 MolecularWeight: 354.31026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)O2

Isomeric SMILES

CC(C(=O)O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC4=C(C=C3)OCO4)O2

InChI

InChI=1S/C19H14O7/c1-10(19(21)22)25-12-3-4-13-15(8-12)26-17(18(13)20)7-11-2-5-14-16(6-11)24-9-23-14/h2-8,10H,9H2,1H3,(H,21,22)