2-(3-bromanylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-(3-bromanylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]ethanone Formula: C18H17BrF3N3O2 MolecularWeight: 444.24569

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrF3N3O2/c19-14-2-1-3-15(10-14)27-12-17(26)25-8-6-24(7-9-25)16-5-4-13(11-23-16)18(20,21)22/h1-5,10-11H,6-9,12H2