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

Systemtic Name: 2-(4-ethanoylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 2-(4-acetylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 2-(4-acetylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 2-(4-acetylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]ethanone Formula: C20H20F3N3O3 MolecularWeight: 407.38631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O3/c1-14(27)15-2-5-17(6-3-15)29-13-19(28)26-10-8-25(9-11-26)18-7-4-16(12-24-18)20(21,22)23/h2-7,12H,8-11,13H2,1H3