[(2R)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-methyl-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]azanium

Systemtic Name: [(2R)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]-methyl-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]azanium Openeye Name: [(1R)-2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-1-methyl-2-oxo-ethyl]-methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]ammonium CAS Name: [(2R)-1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-1-oxopropan-2-yl]-methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]ammonium IUPAC Name: [(2R)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl]-methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]azanium Traditional Name: [(1R)-2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-1-methyl-ethyl]-[2-keto-2-[2-(trifluoromethyl)anilino]ethyl]-methyl-ammonium Formula: C20H29F3N3O2+ MolecularWeight: 400.45837

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C(C)[NH+](C)CC(=O)NC2=CC=CC=C2C(F)(F)F)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)[C@@H](C)[NH+](C)CC(=O)NC2=CC=CC=C2C(F)(F)F)C

InChI

InChI=1S/C20H28F3N3O2/c1-13-8-7-9-14(2)26(13)19(28)15(3)25(4)12-18(27)24-17-11-6-5-10-16(17)20(21,22)23/h5-6,10-11,13-15H,7-9,12H2,1-4H3,(H,24,27)/p+1/t13-,14-,15-/m1/s1