dimethyl 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-1,2-oxazol-3-yl]methyl]propanedioate

Systemtic Name: dimethyl 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-1,2-oxazol-3-yl]methyl]propanedioate Openeye Name: dimethyl 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-isoxazol-3-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-3-isoxazolyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-1,2-oxazol-3-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[4-(cyanomethyl)-5-methyl-isoxazol-3-yl]methyl]malonic acid dimethyl ester Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)CC(C(=O)OC)(C(=O)OC)NC(=O)C)CC#N

Isomeric SMILES

CC1=C(C(=NO1)CC(C(=O)OC)(C(=O)OC)NC(=O)C)CC#N

InChI

InChI=1S/C14H17N3O6/c1-8-10(5-6-15)11(17-23-8)7-14(12(19)21-3,13(20)22-4)16-9(2)18/h5,7H2,1-4H3,(H,16,18)