2-(pyridin-4-ylcarbonylamino)butanedioic acid

Systemtic Name: 2-(pyridin-4-ylcarbonylamino)butanedioic acid Openeye Name: 2-(pyridine-4-carbonylamino)butanedioic acid CAS Name: 2-[[oxo(pyridin-4-yl)methyl]amino]butanedioic acid IUPAC Name: 2-(pyridine-4-carbonylamino)butanedioic acid Traditional Name: 2-isonicotinamidosuccinic acid Formula: C10H10N2O5 MolecularWeight: 238.1968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CN=CC=C1C(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C10H10N2O5/c13-8(14)5-7(10(16)17)12-9(15)6-1-3-11-4-2-6/h1-4,7H,5H2,(H,12,15)(H,13,14)(H,16,17)