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

Systemtic Name: diethyl 2-acetamido-2-[[3-(diethoxyphosphorylmethoxy)-1,2-oxazol-5-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-(diethoxyphosphorylmethoxy)isoxazol-5-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[3-(diethoxyphosphorylmethoxy)-5-isoxazolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-(diethoxyphosphorylmethoxy)-1,2-oxazol-5-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[[3-(diethoxyphosphorylmethoxy)isoxazol-5-yl]methyl]malonic acid diethyl ester Formula: C18H29N2O10P MolecularWeight: 464.404021

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=NO1)OCP(=O)(OCC)OCC)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC(=NO1)OCP(=O)(OCC)OCC)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H29N2O10P/c1-6-25-16(22)18(19-13(5)21,17(23)26-7-2)11-14-10-15(20-30-14)27-12-31(24,28-8-3)29-9-4/h10H,6-9,11-12H2,1-5H3,(H,19,21)