2-[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[2-[2-[(2-methoxyphenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[2-(3-keto-2-o-anisylidene-coumaran-6-yl)oxyacetyl]amino]propionic acid Formula: C21H19NO8 MolecularWeight: 413.37746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NC(CO)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NC(CO)C(=O)O

InChI

InChI=1S/C21H19NO8/c1-28-16-5-3-2-4-12(16)8-18-20(25)14-7-6-13(9-17(14)30-18)29-11-19(24)22-15(10-23)21(26)27/h2-9,15,23H,10-11H2,1H3,(H,22,24)(H,26,27)