(2S,3R)-6-oxidanylidene-1-propyl-2-pyridin-2-yl-piperidine-3-carboxylic acid

Systemtic Name: (2S,3R)-6-oxidanylidene-1-propyl-2-pyridin-2-yl-piperidine-3-carboxylic acid Openeye Name: (2S,3R)-6-oxo-1-propyl-2-(2-pyridyl)piperidine-3-carboxylic acid CAS Name: (2S,3R)-6-oxo-1-propyl-2-(2-pyridinyl)-3-piperidinecarboxylic acid IUPAC Name: (2S,3R)-6-oxo-1-propyl-2-pyridin-2-ylpiperidine-3-carboxylic acid Traditional Name: (2S,3R)-6-keto-1-propyl-2-(2-pyridyl)nipecotic acid Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(CCC1=O)C(=O)O)C2=CC=CC=N2

Isomeric SMILES

CCCN1[C@@H]([C@@H](CCC1=O)C(=O)O)C2=CC=CC=N2

InChI

InChI=1S/C14H18N2O3/c1-2-9-16-12(17)7-6-10(14(18)19)13(16)11-5-3-4-8-15-11/h3-5,8,10,13H,2,6-7,9H2,1H3,(H,18,19)/t10-,13+/m1/s1