methyl (2R)-1-piperidin-1-ium-4-ylcarbonylpiperazine-2-carboxylate

Systemtic Name: methyl (2R)-1-piperidin-1-ium-4-ylcarbonylpiperazine-2-carboxylate Openeye Name: methyl (2R)-1-(piperidin-1-ium-4-carbonyl)piperazine-2-carboxylate CAS Name: (2R)-1-[oxo(4-piperidin-1-iumyl)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-1-(piperidin-1-ium-4-carbonyl)piperazine-2-carboxylate Traditional Name: (2R)-1-(piperidin-1-ium-4-carbonyl)piperazine-2-carboxylic acid methyl ester Formula: C12H22N3O3+ MolecularWeight: 256.32138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CNCCN1C(=O)C2CC[NH2+]CC2

Isomeric SMILES

COC(=O)[C@H]1CNCCN1C(=O)C2CC[NH2+]CC2

InChI

InChI=1S/C12H21N3O3/c1-18-12(17)10-8-14-6-7-15(10)11(16)9-2-4-13-5-3-9/h9-10,13-14H,2-8H2,1H3/p+1/t10-/m1/s1