diethyl 2-[2-(1,2,4-triazol-1-yl)ethanoylamino]propanedioate

Systemtic Name: diethyl 2-[2-(1,2,4-triazol-1-yl)ethanoylamino]propanedioate Openeye Name: diethyl 2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]propanedioate CAS Name: 2-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]propanedioate Traditional Name: 2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]malonic acid diethyl ester Formula: C11H16N4O5 MolecularWeight: 284.26854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)CN1C=NC=N1

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)CN1C=NC=N1

InChI

InChI=1S/C11H16N4O5/c1-3-19-10(17)9(11(18)20-4-2)14-8(16)5-15-7-12-6-13-15/h6-7,9H,3-5H2,1-2H3,(H,14,16)