ethyl 1-(2-piperazin-1-ium-1-ylethanoyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-piperazin-1-ium-1-ylethanoyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(2-piperazin-1-ium-1-ylacetyl)piperidine-4-carboxylate CAS Name: 1-[1-oxo-2-(1-piperazin-1-iumyl)ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-piperazin-1-ium-1-ylacetyl)piperidine-4-carboxylate Traditional Name: 1-(2-piperazin-1-ium-1-ylacetyl)isonipecotic acid ethyl ester Formula: C14H26N3O3+ MolecularWeight: 284.37454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C[NH+]2CCNCC2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C[NH+]2CCNCC2

InChI

InChI=1S/C14H25N3O3/c1-2-20-14(19)12-3-7-17(8-4-12)13(18)11-16-9-5-15-6-10-16/h12,15H,2-11H2,1H3/p+1