4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione

Systemtic Name: 4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione Openeye Name: 4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione CAS Name: 4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]-1-piperazin-1-iumyl]methyl]piperidine-2,6-dione IUPAC Name: 4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione Traditional Name: 4-ethyl-4-methyl-1-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]methyl]piperidine-2,6-quinone Formula: C20H27F3N3O2+ MolecularWeight: 398.44249

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=O)N(C(=O)C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCC1(CC(=O)N(C(=O)C1)C[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C20H26F3N3O2/c1-3-19(2)12-17(27)26(18(28)13-19)14-24-7-9-25(10-8-24)16-6-4-5-15(11-16)20(21,22)23/h4-6,11H,3,7-10,12-14H2,1-2H3/p+1