diethyl 2-acetamido-2-[(5-methyl-3-oxidanyl-imidazol-4-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(5-methyl-3-oxidanyl-imidazol-4-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(3-hydroxy-5-methyl-imidazol-4-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(3-hydroxy-5-methyl-4-imidazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(3-hydroxy-5-methylimidazol-4-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(3-hydroxy-5-methyl-imidazol-4-yl)methyl]malonic acid diethyl ester Formula: C14H21N3O6 MolecularWeight: 327.33304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(N=CN1O)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(N=CN1O)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C14H21N3O6/c1-5-22-12(19)14(16-10(4)18,13(20)23-6-2)7-11-9(3)15-8-17(11)21/h8,21H,5-7H2,1-4H3,(H,16,18)