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

Systemtic Name: N-methyl-2-[(2R)-3-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-N-methyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]acetamide CAS Name: N-methyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-2-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: N-methyl-2-[(2R)-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-ium-2-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(2R)-3-keto-1-[3-(trifluoromethyl)benzyl]piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C18H25F3N3O2+ MolecularWeight: 372.40521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C(=O)CC1C(=O)NCC[NH+]1CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)N(C)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C18H24F3N3O2/c1-12(2)23(3)16(25)10-15-17(26)22-7-8-24(15)11-13-5-4-6-14(9-13)18(19,20)21/h4-6,9,12,15H,7-8,10-11H2,1-3H3,(H,22,26)/p+1/t15-/m1/s1