2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-[[2-(trifluoromethyloxy)phenyl]methyl]ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-[[2-(trifluoromethyloxy)phenyl]methyl]ethanamide Openeye Name: 2-[(2R)-1-isopropyl-3-oxo-piperazin-1-ium-2-yl]-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide CAS Name: 2-[(2R)-3-oxo-1-propan-2-yl-2-piperazin-1-iumyl]-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide IUPAC Name: 2-[(2R)-3-oxo-1-propan-2-ylpiperazin-1-ium-2-yl]-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide Traditional Name: 2-[(2R)-1-isopropyl-3-keto-piperazin-1-ium-2-yl]-N-[2-(trifluoromethoxy)benzyl]acetamide Formula: C17H23F3N3O3+ MolecularWeight: 374.37803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCNC(=O)C1CC(=O)NCC2=CC=CC=C2OC(F)(F)F

Isomeric SMILES

CC(C)[NH+]1CCNC(=O)[C@H]1CC(=O)NCC2=CC=CC=C2OC(F)(F)F

InChI

InChI=1S/C17H22F3N3O3/c1-11(2)23-8-7-21-16(25)13(23)9-15(24)22-10-12-5-3-4-6-14(12)26-17(18,19)20/h3-6,11,13H,7-10H2,1-2H3,(H,21,25)(H,22,24)/p+1/t13-/m1/s1