N-[2-(4-bromanylphenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-(4-bromanylphenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(4-bromophenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(4-bromophenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(4-bromophenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(4-bromophenoxy)-5-(trifluoromethyl)phenyl]-2-(4-methylpiperazin-1-ium-1-yl)acetamide Formula: C20H22BrF3N3O2+ MolecularWeight: 473.30679

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)Br

Isomeric SMILES

CN1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrF3N3O2/c1-26-8-10-27(11-9-26)13-19(28)25-17-12-14(20(22,23)24)2-7-18(17)29-16-5-3-15(21)4-6-16/h2-7,12H,8-11,13H2,1H3,(H,25,28)/p+1