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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CO)C(=O)OC)N1C=NC=N1

Isomeric SMILES

CC(C(=O)NC(CO)C(=O)OC)N1C=NC=N1

InChI

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