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

Systemtic Name: methyl 3-oxidanyl-2-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[(1-phenyltriazole-4-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[oxo-(1-phenyl-4-triazolyl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(1-phenyltriazole-4-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[(1-phenyltriazole-4-carbonyl)amino]propionic acid methyl ester Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CN(N=N1)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CN(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H14N4O4/c1-21-13(20)11(8-18)14-12(19)10-7-17(16-15-10)9-5-3-2-4-6-9/h2-7,11,18H,8H2,1H3,(H,14,19)