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

Systemtic Name: (2S)-3-oxidanyl-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate Openeye Name: (2S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propionate Formula: C8H11N4O4- MolecularWeight: 227.19734

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C=N1)CCC(=O)NC(CO)C(=O)[O-]

Isomeric SMILES

C1=NN(C=N1)CCC(=O)N[C@@H](CO)C(=O)[O-]

InChI

InChI=1S/C8H12N4O4/c13-3-6(8(15)16)11-7(14)1-2-12-5-9-4-10-12/h4-6,13H,1-3H2,(H,11,14)(H,15,16)/p-1/t6-/m0/s1