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

Systemtic Name: 2-[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[[2-[2-[(2-methoxyphenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[2-[[2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[2-(3-keto-2-o-anisylidene-coumaran-6-yl)oxyacetyl]amino]butyric acid Formula: C22H21NO8 MolecularWeight: 427.40404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3OC)O2)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3OC)O2)O

InChI

InChI=1S/C22H21NO8/c1-12(24)20(22(27)28)23-19(25)11-30-14-7-8-15-17(10-14)31-18(21(15)26)9-13-5-3-4-6-16(13)29-2/h3-10,12,20,24H,11H2,1-2H3,(H,23,25)(H,27,28)