methyl 3-oxidanyl-2-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[[6-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]propanoate CAS Name: 3-hydroxy-2-[[oxo-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[6-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]propanoate Traditional Name: 3-hydroxy-2-[[6-(1,2,4-triazol-1-yl)nicotinoyl]amino]propionic acid methyl ester Formula: C12H13N5O4 MolecularWeight: 291.26272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CN=C(C=C1)N2C=NC=N2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CN=C(C=C1)N2C=NC=N2

InChI

InChI=1S/C12H13N5O4/c1-21-12(20)9(5-18)16-11(19)8-2-3-10(14-4-8)17-7-13-6-15-17/h2-4,6-7,9,18H,5H2,1H3,(H,16,19)