2-(4-bromanylphenoxy)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one Openeye Name: 2-(4-bromophenoxy)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one CAS Name: 2-(4-bromophenoxy)-1-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propan-1-one Traditional Name: 2-(4-bromophenoxy)-1-[4-[3-(trifluoromethyl)phenyl]piperazino]propan-1-one Formula: C20H20BrF3N2O2 MolecularWeight: 457.28421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrF3N2O2/c1-14(28-18-7-5-16(21)6-8-18)19(27)26-11-9-25(10-12-26)17-4-2-3-15(13-17)20(22,23)24/h2-8,13-14H,9-12H2,1H3