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

Systemtic Name: ethyl (3S)-1-piperidin-1-ium-4-ylcarbonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-(piperidin-1-ium-4-carbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[oxo(4-piperidin-1-iumyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-(piperidin-1-ium-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(piperidin-1-ium-4-carbonyl)nipecotic acid ethyl ester Formula: C14H25N2O3+ MolecularWeight: 269.3599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2O3/c1-2-19-14(18)12-4-3-9-16(10-12)13(17)11-5-7-15-8-6-11/h11-12,15H,2-10H2,1H3/p+1/t12-/m0/s1