dimethyl 2-acetamido-2-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl]propanedioate

Systemtic Name: dimethyl 2-acetamido-2-[(5-oxidanyl-4-oxidanylidene-pyran-2-yl)methyl]propanedioate Openeye Name: dimethyl 2-acetamido-2-[(5-hydroxy-4-oxo-pyran-2-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(5-hydroxy-4-oxo-2-pyranyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-acetamido-2-[(5-hydroxy-4-oxopyran-2-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(5-hydroxy-4-keto-pyran-2-yl)methyl]malonic acid dimethyl ester Formula: C13H15NO8 MolecularWeight: 313.2601

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=O)C(=CO1)O)(C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=CC(=O)C(=CO1)O)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C13H15NO8/c1-7(15)14-13(11(18)20-2,12(19)21-3)5-8-4-9(16)10(17)6-22-8/h4,6,17H,5H2,1-3H3,(H,14,15)