2-[3-(1,2,4-triazol-1-yl)propanoylamino]ethanoate

Systemtic Name: 2-[3-(1,2,4-triazol-1-yl)propanoylamino]ethanoate Openeye Name: 2-[3-(1,2,4-triazol-1-yl)propanoylamino]acetate CAS Name: 2-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]acetate IUPAC Name: 2-[3-(1,2,4-triazol-1-yl)propanoylamino]acetate Traditional Name: 2-[3-(1,2,4-triazol-1-yl)propanoylamino]acetate Formula: C7H9N4O3- MolecularWeight: 197.17136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10N4O3/c12-6(9-3-7(13)14)1-2-11-5-8-4-10-11/h4-5H,1-3H2,(H,9,12)(H,13,14)/p-1