ethyl 1-(3-piperazin-4-ium-1-ylpropanoyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-piperazin-4-ium-1-ylpropanoyl)piperidine-4-carboxylate Openeye Name: ethyl 1-(3-piperazin-4-ium-1-ylpropanoyl)piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-(1-piperazin-4-iumyl)propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-piperazin-4-ium-1-ylpropanoyl)piperidine-4-carboxylate Traditional Name: 1-(3-piperazin-4-ium-1-ylpropanoyl)isonipecotic acid ethyl ester Formula: C15H28N3O3+ MolecularWeight: 298.40112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCN2CC[NH2+]CC2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCN2CC[NH2+]CC2

InChI

InChI=1S/C15H27N3O3/c1-2-21-15(20)13-3-9-18(10-4-13)14(19)5-8-17-11-6-16-7-12-17/h13,16H,2-12H2,1H3/p+1