2-[2-[4-[4-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-3H-isoindol-1-one

Systemtic Name: 2-[2-[4-[4-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-3H-isoindol-1-one Openeye Name: 2-[2-[4-[4-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethyl]isoindolin-1-one CAS Name: 2-[2-[4-[4-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-[4-[4-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-3H-isoindol-1-one Traditional Name: 2-[2-[4-[4-(trifluoromethyl)-2-pyridyl]piperazino]ethyl]isoindolin-1-one Formula: C20H21F3N4O MolecularWeight: 390.40215

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2CC3=CC=CC=C3C2=O)C4=NC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCN2CC3=CC=CC=C3C2=O)C4=NC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C20H21F3N4O/c21-20(22,23)16-5-6-24-18(13-16)26-10-7-25(8-11-26)9-12-27-14-15-3-1-2-4-17(15)19(27)28/h1-6,13H,7-12,14H2