tert-butyl 3-(4-piperidin-4-ylpiperazin-4-ium-1-yl)propanoate

Systemtic Name: tert-butyl 3-(4-piperidin-4-ylpiperazin-4-ium-1-yl)propanoate Openeye Name: tert-butyl 3-[4-(4-piperidyl)piperazin-4-ium-1-yl]propanoate CAS Name: 3-[4-(4-piperidinyl)-1-piperazin-4-iumyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-piperidin-4-ylpiperazin-4-ium-1-yl)propanoate Traditional Name: 3-[4-(4-piperidyl)piperazin-4-ium-1-yl]propionic acid tert-butyl ester Formula: C16H32N3O2+ MolecularWeight: 298.44418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN1CC[NH+](CC1)C2CCNCC2

Isomeric SMILES

CC(C)(C)OC(=O)CCN1CC[NH+](CC1)C2CCNCC2

InChI

InChI=1S/C16H31N3O2/c1-16(2,3)21-15(20)6-9-18-10-12-19(13-11-18)14-4-7-17-8-5-14/h14,17H,4-13H2,1-3H3/p+1