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

Systemtic Name: N-cyclohexyl-2-[(2R)-3-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]ethanamide Openeye Name: N-cyclohexyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]acetamide CAS Name: N-cyclohexyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclohexyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]acetamide Traditional Name: N-cyclohexyl-2-[(2R)-3-keto-1-[3-(trifluoromethyl)benzyl]piperazin-1-ium-2-yl]acetamide Formula: C20H27F3N3O2+ MolecularWeight: 398.44249

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CC2C(=O)NCC[NH+]2CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)NC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H26F3N3O2/c21-20(22,23)15-6-4-5-14(11-15)13-26-10-9-24-19(28)17(26)12-18(27)25-16-7-2-1-3-8-16/h4-6,11,16-17H,1-3,7-10,12-13H2,(H,24,28)(H,25,27)/p+1/t17-/m1/s1