4-[2-[[(2Z)-3-oxidanylidene-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]ethanoylamino]butanoic acid

Systemtic Name: 4-[2-[[(2Z)-3-oxidanylidene-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]ethanoylamino]butanoic acid Openeye Name: 4-[[2-[(2Z)-3-oxo-2-(2-thienylmethylene)benzofuran-6-yl]oxyacetyl]amino]butanoic acid CAS Name: 4-[[1-oxo-2-[[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-6-benzofuranyl]oxy]ethyl]amino]butanoic acid IUPAC Name: 4-[[2-[[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]acetyl]amino]butanoic acid Traditional Name: 4-[[2-[(2Z)-3-keto-2-(2-thenylidene)coumaran-6-yl]oxyacetyl]amino]butyric acid Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NCCCC(=O)O

InChI

InChI=1S/C19H17NO6S/c21-17(20-7-1-4-18(22)23)11-25-12-5-6-14-15(9-12)26-16(19(14)24)10-13-3-2-8-27-13/h2-3,5-6,8-10H,1,4,7,11H2,(H,20,21)(H,22,23)/b16-10-