2-acetamido-2-but-3-yn-2-yl-propanedioic acid

Systemtic Name: 2-acetamido-2-but-3-yn-2-yl-propanedioic acid Openeye Name: 2-acetamido-2-(1-methylprop-2-ynyl)propanedioic acid CAS Name: 2-acetamido-2-but-3-yn-2-ylpropanedioic acid IUPAC Name: 2-acetamido-2-but-3-yn-2-ylpropanedioic acid Traditional Name: 2-acetamido-2-(1-methylprop-2-ynyl)malonic acid Formula: C9H11NO5 MolecularWeight: 213.18734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)C(C(=O)O)(C(=O)O)NC(=O)C

Isomeric SMILES

CC(C#C)C(C(=O)O)(C(=O)O)NC(=O)C

InChI

InChI=1S/C9H11NO5/c1-4-5(2)9(7(12)13,8(14)15)10-6(3)11/h1,5H,2-3H3,(H,10,11)(H,12,13)(H,14,15)