(2S,3S)-3-oxidanyl-2-(quinolin-2-ylcarbonylamino)butanoate

Systemtic Name: (2S,3S)-3-oxidanyl-2-(quinolin-2-ylcarbonylamino)butanoate Openeye Name: (2S,3S)-3-hydroxy-2-(quinoline-2-carbonylamino)butanoate CAS Name: (2S,3S)-3-hydroxy-2-[[oxo(2-quinolinyl)methyl]amino]butanoate IUPAC Name: (2S,3S)-3-hydroxy-2-(quinoline-2-carbonylamino)butanoate Traditional Name: (2S,3S)-3-hydroxy-2-(quinaldoylamino)butyrate Formula: C14H13N2O4- MolecularWeight: 273.26402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1=NC2=CC=CC=C2C=C1)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)C1=NC2=CC=CC=C2C=C1)O

InChI

InChI=1S/C14H14N2O4/c1-8(17)12(14(19)20)16-13(18)11-7-6-9-4-2-3-5-10(9)15-11/h2-8,12,17H,1H3,(H,16,18)(H,19,20)/p-1/t8-,12-/m0/s1