(2S)-2-(1-benzofuran-2-ylcarbonylamino)-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-(1-benzofuran-2-ylcarbonylamino)-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-(benzofuran-2-carbonylamino)-3-hydroxy-propanoic acid CAS Name: (2S)-2-[[2-benzofuranyl(oxo)methyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-(1-benzofuran-2-carbonylamino)-3-hydroxypropanoic acid Traditional Name: (2S)-2-(benzofuran-2-carbonylamino)-3-hydroxy-propionic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)N[C@@H](CO)C(=O)O

InChI

InChI=1S/C12H11NO5/c14-6-8(12(16)17)13-11(15)10-5-7-3-1-2-4-9(7)18-10/h1-5,8,14H,6H2,(H,13,15)(H,16,17)/t8-/m0/s1