3-[2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]propanoate

Systemtic Name: 3-[2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]propanoate Openeye Name: 3-[[2-[(2Z)-2-(1,3-benzodioxol-5-ylmethylene)-3-oxo-benzofuran-6-yl]oxyacetyl]amino]propanoate CAS Name: 3-[[2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]amino]propanoate IUPAC Name: 3-[[2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]acetyl]amino]propanoate Traditional Name: 3-[[2-[(2Z)-3-keto-2-piperonylidene-coumaran-6-yl]oxyacetyl]amino]propionate Formula: C21H16NO8- MolecularWeight: 410.35364

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC(=O)NCCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\3/C(=O)C4=C(O3)C=C(C=C4)OCC(=O)NCCC(=O)[O-]

InChI

InChI=1S/C21H17NO8/c23-19(22-6-5-20(24)25)10-27-13-2-3-14-16(9-13)30-18(21(14)26)8-12-1-4-15-17(7-12)29-11-28-15/h1-4,7-9H,5-6,10-11H2,(H,22,23)(H,24,25)/p-1/b18-8-