methyl 1-[(2S)-pyrrolidin-1-ium-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[(2S)-pyrrolidin-1-ium-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[(2S)-pyrrolidin-1-ium-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[(2S)-2-pyrrolidin-1-iumyl]methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(2S)-pyrrolidin-1-ium-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(2S)-pyrrolidin-1-ium-2-carbonyl]isonipecotic acid methyl ester Formula: C12H21N2O3+ MolecularWeight: 241.30674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2CCC[NH2+]2

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O3/c1-17-12(16)9-4-7-14(8-5-9)11(15)10-3-2-6-13-10/h9-10,13H,2-8H2,1H3/p+1/t10-/m0/s1