(2S,3S)-3-oxidanyl-2-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]butanoate

Systemtic Name: (2S,3S)-3-oxidanyl-2-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]butanoate Openeye Name: (2S,3S)-3-hydroxy-2-[(2-phenyltriazole-4-carbonyl)amino]butanoate CAS Name: (2S,3S)-3-hydroxy-2-[[oxo-(2-phenyl-4-triazolyl)methyl]amino]butanoate IUPAC Name: (2S,3S)-3-hydroxy-2-[(2-phenyltriazole-4-carbonyl)amino]butanoate Traditional Name: (2S,3S)-3-hydroxy-2-[(2-phenyltriazole-4-carbonyl)amino]butyrate Formula: C13H13N4O4- MolecularWeight: 289.26672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)C1=NN(N=C1)C2=CC=CC=C2)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)C1=NN(N=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C13H14N4O4/c1-8(18)11(13(20)21)15-12(19)10-7-14-17(16-10)9-5-3-2-4-6-9/h2-8,11,18H,1H3,(H,15,19)(H,20,21)/p-1/t8-,11-/m0/s1