ethyl 1-[(3S)-piperidin-1-ium-3-yl]carbonylpiperidine-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCC[NH2+]C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)[C@H]2CCC[NH2+]C2

InChI

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