2,2-dimethyl-1-[(2S)-2-(2-piperazin-4-ium-1-ylethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[(2S)-2-(2-piperazin-4-ium-1-ylethyl)piperidin-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[(2S)-2-(2-piperazin-4-ium-1-ylethyl)-1-piperidyl]propan-1-one CAS Name: 2,2-dimethyl-1-[(2S)-2-[2-(1-piperazin-4-iumyl)ethyl]-1-piperidinyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[(2S)-2-(2-piperazin-4-ium-1-ylethyl)piperidin-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[(2S)-2-(2-piperazin-4-ium-1-ylethyl)piperidino]propan-1-one Formula: C16H32N3O+ MolecularWeight: 282.44478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCCCC1CCN2CC[NH2+]CC2

Isomeric SMILES

CC(C)(C)C(=O)N1CCCC[C@H]1CCN2CC[NH2+]CC2

InChI

InChI=1S/C16H31N3O/c1-16(2,3)15(20)19-10-5-4-6-14(19)7-11-18-12-8-17-9-13-18/h14,17H,4-13H2,1-3H3/p+1/t14-/m0/s1