(2S,3S)-2-(1-benzofuran-2-ylcarbonylamino)-3-oxidanyl-butanoate

Systemtic Name: (2S,3S)-2-(1-benzofuran-2-ylcarbonylamino)-3-oxidanyl-butanoate Openeye Name: (2S,3S)-2-(benzofuran-2-carbonylamino)-3-hydroxy-butanoate CAS Name: (2S,3S)-2-[[2-benzofuranyl(oxo)methyl]amino]-3-hydroxybutanoate IUPAC Name: (2S,3S)-2-(1-benzofuran-2-carbonylamino)-3-hydroxybutanoate Traditional Name: (2S,3S)-2-(benzofuran-2-carbonylamino)-3-hydroxy-butyrate Formula: C13H12NO5- MolecularWeight: 262.23808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1=CC2=CC=CC=C2O1)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)C1=CC2=CC=CC=C2O1)O

InChI

InChI=1S/C13H13NO5/c1-7(15)11(13(17)18)14-12(16)10-6-8-4-2-3-5-9(8)19-10/h2-7,11,15H,1H3,(H,14,16)(H,17,18)/p-1/t7-,11-/m0/s1