2-[[3-oxidanylidene-2-[(2,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]propanoic acid

Systemtic Name: 2-[[3-oxidanylidene-2-[(2,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]propanoic acid Openeye Name: 2-[3-oxo-2-[(2,4,5-trimethoxyphenyl)methylene]benzofuran-6-yl]oxypropanoic acid CAS Name: 2-[[3-oxo-2-[(2,4,5-trimethoxyphenyl)methylidene]-6-benzofuranyl]oxy]propanoic acid IUPAC Name: 2-[[3-oxo-2-[(2,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]propanoic acid Traditional Name: 2-[3-keto-2-(2,4,5-trimethoxybenzylidene)coumaran-6-yl]oxypropionic acid Formula: C21H20O8 MolecularWeight: 400.3787

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=CC(=C(C=C3OC)OC)OC)O2

Isomeric SMILES

CC(C(=O)O)OC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=C(C=C3OC)OC)OC)O2

InChI

InChI=1S/C21H20O8/c1-11(21(23)24)28-13-5-6-14-16(9-13)29-19(20(14)22)8-12-7-17(26-3)18(27-4)10-15(12)25-2/h5-11H,1-4H3,(H,23,24)