(3S)-1-(5-cyanopyridin-2-yl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(5-cyanopyridin-2-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(5-cyano-2-pyridyl)piperidine-3-carboxylate CAS Name: (3S)-1-(5-cyano-2-pyridinyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(5-cyanopyridin-2-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(5-cyano-2-pyridyl)nipecotate Formula: C12H12N3O2- MolecularWeight: 230.24258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=C2)C#N)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=C2)C#N)C(=O)[O-]

InChI

InChI=1S/C12H13N3O2/c13-6-9-3-4-11(14-7-9)15-5-1-2-10(8-15)12(16)17/h3-4,7,10H,1-2,5,8H2,(H,16,17)/p-1/t10-/m0/s1