N-(4-bromophenyl)-2-[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]acetamide Formula: C20H21BrF3N2O2+ MolecularWeight: 458.29215

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1C[NH+](CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrF3N2O2/c21-16-4-6-17(7-5-16)25-18(27)13-26-10-8-19(28,9-11-26)14-2-1-3-15(12-14)20(22,23)24/h1-7,12,28H,8-11,13H2,(H,25,27)/p+1