1-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-oxo-2-(pyrimidin-2-ylamino)ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-oxo-2-(2-pyrimidinylamino)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-oxo-2-(pyrimidin-2-ylamino)ethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-keto-2-(2-pyrimidylamino)ethyl]nipecotic acid Formula: C12H16N4O3 MolecularWeight: 264.28044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NC2=NC=CC=N2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC(=O)NC2=NC=CC=N2)C(=O)O

InChI

InChI=1S/C12H16N4O3/c17-10(15-12-13-4-2-5-14-12)8-16-6-1-3-9(7-16)11(18)19/h2,4-5,9H,1,3,6-8H2,(H,18,19)(H,13,14,15,17)