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

Systemtic Name: 3-[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[2-[(2-methoxyphenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetyl]amino]propanoic acid CAS Name: 3-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetyl]amino]propanoic acid Traditional Name: 3-[[2-(3-keto-2-o-anisylidene-coumaran-6-yl)oxyacetyl]amino]propionic acid Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO7/c1-27-16-5-3-2-4-13(16)10-18-21(26)15-7-6-14(11-17(15)29-18)28-12-19(23)22-9-8-20(24)25/h2-7,10-11H,8-9,12H2,1H3,(H,22,23)(H,24,25)