3-[2-[[(2E)-2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]propanoate

Systemtic Name: 3-[2-[[(2E)-2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]propanoate Openeye Name: 3-[[2-[(2E)-2-[(4-methoxyphenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetyl]amino]propanoate CAS Name: 3-[[2-[[(2E)-2-[(4-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]amino]propanoate IUPAC Name: 3-[[2-[[(2E)-2-[(4-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetyl]amino]propanoate Traditional Name: 3-[[2-[(2E)-3-keto-2-p-anisylidene-coumaran-6-yl]oxyacetyl]amino]propionate Formula: C21H18NO7- MolecularWeight: 396.37012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NCCC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/2\C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NCCC(=O)[O-]

InChI

InChI=1S/C21H19NO7/c1-27-14-4-2-13(3-5-14)10-18-21(26)16-7-6-15(11-17(16)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)/p-1/b18-10+