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

Systemtic Name: (2S,3S)-3-oxidanyl-2-[3-(1,2,4-triazol-1-yl)propanoylamino]butanoate Openeye Name: (2S,3S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]butanoate CAS Name: (2S,3S)-3-hydroxy-2-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]butanoate IUPAC Name: (2S,3S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]butanoate Traditional Name: (2S,3S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]butyrate Formula: C9H13N4O4- MolecularWeight: 241.22392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)[O-])NC(=O)CCN1C=NC=N1)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)[O-])NC(=O)CCN1C=NC=N1)O

InChI

InChI=1S/C9H14N4O4/c1-6(14)8(9(16)17)12-7(15)2-3-13-5-10-4-11-13/h4-6,8,14H,2-3H2,1H3,(H,12,15)(H,16,17)/p-1/t6-,8-/m0/s1