2-acetamido-2-(pyridin-3-ylmethyl)propanedioic acid

Systemtic Name: 2-acetamido-2-(pyridin-3-ylmethyl)propanedioic acid Openeye Name: 2-acetamido-2-(3-pyridylmethyl)propanedioic acid CAS Name: 2-acetamido-2-(3-pyridinylmethyl)propanedioic acid IUPAC Name: 2-acetamido-2-(pyridin-3-ylmethyl)propanedioic acid Traditional Name: 2-acetamido-2-(3-pyridylmethyl)malonic acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CN=CC=C1)(C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CN=CC=C1)(C(=O)O)C(=O)O

InChI

InChI=1S/C11H12N2O5/c1-7(14)13-11(9(15)16,10(17)18)5-8-3-2-4-12-6-8/h2-4,6H,5H2,1H3,(H,13,14)(H,15,16)(H,17,18)