diethyl 2-acetamido-2-(3-cyano-3-oxidanyl-propyl)propanedioate

Systemtic Name: diethyl 2-acetamido-2-(3-cyano-3-oxidanyl-propyl)propanedioate Openeye Name: diethyl 2-acetamido-2-(3-cyano-3-hydroxy-propyl)propanedioate CAS Name: 2-acetamido-2-(3-cyano-3-hydroxypropyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-(3-cyano-3-hydroxypropyl)propanedioate Traditional Name: 2-acetamido-2-(3-cyano-3-hydroxy-propyl)malonic acid diethyl ester Formula: C13H20N2O6 MolecularWeight: 300.3077

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(C#N)O)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCC(C#N)O)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C13H20N2O6/c1-4-20-11(18)13(15-9(3)16,12(19)21-5-2)7-6-10(17)8-14/h10,17H,4-7H2,1-3H3,(H,15,16)