(2S)-2-azanyl-3-[2,3-bis(oxidanylidene)-1-benzofuran-5-yl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[2,3-bis(oxidanylidene)-1-benzofuran-5-yl]propanoic acid Openeye Name: (2S)-2-amino-3-(2,3-dioxobenzofuran-5-yl)propanoic acid CAS Name: (2S)-2-amino-3-(2,3-dioxo-5-benzofuranyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(2,3-dioxo-1-benzofuran-5-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(2,3-diketocoumaran-5-yl)propionic acid Formula: C11H9NO5 MolecularWeight: 235.19286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC(C(=O)O)N)C(=O)C(=O)O2

Isomeric SMILES

C1=CC2=C(C=C1C[C@@H](C(=O)O)N)C(=O)C(=O)O2

InChI

InChI=1S/C11H9NO5/c12-7(10(14)15)4-5-1-2-8-6(3-5)9(13)11(16)17-8/h1-3,7H,4,12H2,(H,14,15)/t7-/m0/s1