diethyl 2-acetamido-2-[(5-cyano-3-ethoxy-1,2-oxazol-4-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(5-cyano-3-ethoxy-1,2-oxazol-4-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(5-cyano-3-ethoxy-isoxazol-4-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(5-cyano-3-ethoxy-4-isoxazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(5-cyano-3-ethoxy-1,2-oxazol-4-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(5-cyano-3-ethoxy-isoxazol-4-yl)methyl]malonic acid diethyl ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C#N

Isomeric SMILES

CCOC1=NOC(=C1CC(C(=O)OCC)(C(=O)OCC)NC(=O)C)C#N

InChI

InChI=1S/C16H21N3O7/c1-5-23-13-11(12(9-17)26-19-13)8-16(18-10(4)20,14(21)24-6-2)15(22)25-7-3/h5-8H2,1-4H3,(H,18,20)