diethyl 2-acetamido-2-[(1-oxidanylimidazol-2-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(1-oxidanylimidazol-2-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(1-hydroxyimidazol-2-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(1-hydroxy-2-imidazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(1-hydroxyimidazol-2-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(1-hydroxyimidazol-2-yl)methyl]malonic acid diethyl ester Formula: C13H19N3O6 MolecularWeight: 313.30646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O6/c1-4-21-11(18)13(15-9(3)17,12(19)22-5-2)8-10-14-6-7-16(10)20/h6-7,20H,4-5,8H2,1-3H3,(H,15,17)