2-oxidanylidene-3-(2-pyridin-4-ylethyl)piperidine-3-carboxylic acid

Systemtic Name: 2-oxidanylidene-3-(2-pyridin-4-ylethyl)piperidine-3-carboxylic acid Openeye Name: 2-oxo-3-[2-(4-pyridyl)ethyl]piperidine-3-carboxylic acid CAS Name: 2-oxo-3-(2-pyridin-4-ylethyl)-3-piperidinecarboxylic acid IUPAC Name: 2-oxo-3-(2-pyridin-4-ylethyl)piperidine-3-carboxylic acid Traditional Name: 2-keto-3-[2-(4-pyridyl)ethyl]nipecotic acid Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)(CCC2=CC=NC=C2)C(=O)O

Isomeric SMILES

C1CC(C(=O)NC1)(CCC2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C13H16N2O3/c16-11-13(12(17)18,5-1-7-15-11)6-2-10-3-8-14-9-4-10/h3-4,8-9H,1-2,5-7H2,(H,15,16)(H,17,18)