ethyl (3R)-1-(1-oxidanidylpyridin-1-ium-2-yl)piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-1-(1-oxidanidylpyridin-1-ium-2-yl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-(1-oxidopyridin-1-ium-2-yl)piperidine-3-carboxylate CAS Name: (3R)-1-(1-oxido-2-pyridin-1-iumyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-(1-oxidopyridin-1-ium-2-yl)piperidine-3-carboxylate Traditional Name: (3R)-1-(1-oxidopyridin-1-ium-2-yl)nipecotic acid ethyl ester Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=CC=CC=[N+]2[O-]

Isomeric SMILES

CCOC(=O)[C@@H]1CCCN(C1)C2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C13H18N2O3/c1-2-18-13(16)11-6-5-8-14(10-11)12-7-3-4-9-15(12)17/h3-4,7,9,11H,2,5-6,8,10H2,1H3/t11-/m1/s1