methyl 1-piperazin-4-ium-1-ylcarbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-piperazin-4-ium-1-ylcarbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(piperazin-4-ium-1-carbonyl)piperidine-4-carboxylate CAS Name: 1-[oxo(1-piperazin-4-iumyl)methyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(piperazin-4-ium-1-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(piperazin-4-ium-1-carbonyl)isonipecotic acid methyl ester Formula: C12H22N3O3+ MolecularWeight: 256.32138

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C12H21N3O3/c1-18-11(16)10-2-6-14(7-3-10)12(17)15-8-4-13-5-9-15/h10,13H,2-9H2,1H3/p+1