ethyl (3S)-1-piperidin-1-ium-4-ylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-piperidin-1-ium-4-ylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-piperidin-1-ium-4-ylpiperidine-3-carboxylate CAS Name: (3S)-1-(4-piperidin-1-iumyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-piperidin-1-ium-4-ylpiperidine-3-carboxylate Traditional Name: (3S)-1-piperidin-1-ium-4-ylnipecotic acid ethyl ester Formula: C13H25N2O2+ MolecularWeight: 241.3498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2CC[NH2+]CC2

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C2CC[NH2+]CC2

InChI

InChI=1S/C13H24N2O2/c1-2-17-13(16)11-4-3-9-15(10-11)12-5-7-14-8-6-12/h11-12,14H,2-10H2,1H3/p+1/t11-/m0/s1