3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propan-1-one CAS Name: 3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromophenyl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propan-1-one Formula: C19H19BrF3N3O MolecularWeight: 442.27287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CCC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H19BrF3N3O/c20-16-3-1-2-14(12-16)4-7-18(27)26-10-8-25(9-11-26)17-6-5-15(13-24-17)19(21,22)23/h1-3,5-6,12-13H,4,7-11H2