2-acetamido-2-(3-oxidanylidenebutyl)propanedioic acid

Systemtic Name: 2-acetamido-2-(3-oxidanylidenebutyl)propanedioic acid Openeye Name: 2-acetamido-2-(3-oxobutyl)propanedioic acid CAS Name: 2-acetamido-2-(3-oxobutyl)propanedioic acid IUPAC Name: 2-acetamido-2-(3-oxobutyl)propanedioic acid Traditional Name: 2-acetamido-2-(3-ketobutyl)malonic acid Formula: C9H13NO6 MolecularWeight: 231.20262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C(=O)O)(C(=O)O)NC(=O)C

Isomeric SMILES

CC(=O)CCC(C(=O)O)(C(=O)O)NC(=O)C

InChI

InChI=1S/C9H13NO6/c1-5(11)3-4-9(7(13)14,8(15)16)10-6(2)12/h3-4H2,1-2H3,(H,10,12)(H,13,14)(H,15,16)