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

Systemtic Name: 2-(4-methylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-(4-methylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propan-1-one CAS Name: 2-(4-methylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-methylphenoxy)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-(4-methylphenoxy)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propan-1-one Formula: C20H22F3N3O2 MolecularWeight: 393.40279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O2/c1-14-3-6-17(7-4-14)28-15(2)19(27)26-11-9-25(10-12-26)18-8-5-16(13-24-18)20(21,22)23/h3-8,13,15H,9-12H2,1-2H3