2-[(2R)-1-(2,2-dimethylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-pyridin-3-yloxypropyl)ethanamide

Systemtic Name: 2-[(2R)-1-(2,2-dimethylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(3-pyridin-3-yloxypropyl)ethanamide Openeye Name: 2-[(2R)-1-(2,2-dimethylpropyl)-3-oxo-piperazin-1-ium-2-yl]-N-[3-(3-pyridyloxy)propyl]acetamide CAS Name: 2-[(2R)-1-(2,2-dimethylpropyl)-3-oxo-2-piperazin-1-iumyl]-N-[3-(3-pyridinyloxy)propyl]acetamide IUPAC Name: 2-[(2R)-1-(2,2-dimethylpropyl)-3-oxopiperazin-1-ium-2-yl]-N-(3-pyridin-3-yloxypropyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-neopentyl-piperazin-1-ium-2-yl]-N-[3-(3-pyridyloxy)propyl]acetamide Formula: C19H31N4O3+ MolecularWeight: 363.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCNC(=O)C1CC(=O)NCCCOC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)C[NH+]1CCNC(=O)[C@H]1CC(=O)NCCCOC2=CN=CC=C2

InChI

InChI=1S/C19H30N4O3/c1-19(2,3)14-23-10-9-22-18(25)16(23)12-17(24)21-8-5-11-26-15-6-4-7-20-13-15/h4,6-7,13,16H,5,8-12,14H2,1-3H3,(H,21,24)(H,22,25)/p+1/t16-/m1/s1