3-[2,6-bis(oxidanylidene)-3-pyridin-4-yl-piperidin-3-yl]propanoic acid

Systemtic Name: 3-[2,6-bis(oxidanylidene)-3-pyridin-4-yl-piperidin-3-yl]propanoic acid Openeye Name: 3-[2,6-dioxo-3-(4-pyridyl)-3-piperidyl]propanoic acid CAS Name: 3-(2,6-dioxo-3-pyridin-4-yl-3-piperidinyl)propanoic acid IUPAC Name: 3-(2,6-dioxo-3-pyridin-4-ylpiperidin-3-yl)propanoic acid Traditional Name: 3-[2,6-diketo-3-(4-pyridyl)-3-piperidyl]propionic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1=O)(CCC(=O)O)C2=CC=NC=C2

Isomeric SMILES

C1CC(C(=O)NC1=O)(CCC(=O)O)C2=CC=NC=C2

InChI

InChI=1S/C13H14N2O4/c16-10-1-5-13(12(19)15-10,6-2-11(17)18)9-3-7-14-8-4-9/h3-4,7-8H,1-2,5-6H2,(H,17,18)(H,15,16,19)