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

Systemtic Name: methyl 3-oxidanyl-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate CAS Name: 3-hydroxy-2-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propanoate Traditional Name: 3-hydroxy-2-[3-(1,2,4-triazol-1-yl)propanoylamino]propionic acid methyl ester Formula: C9H14N4O4 MolecularWeight: 242.23186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCN1C=NC=N1

Isomeric SMILES

COC(=O)C(CO)NC(=O)CCN1C=NC=N1

InChI

InChI=1S/C9H14N4O4/c1-17-9(16)7(4-14)12-8(15)2-3-13-6-10-5-11-13/h5-7,14H,2-4H2,1H3,(H,12,15)