(E)-3-(2-methylphenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(2-methylphenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(o-tolyl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(2-methylphenyl)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(2-methylphenyl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(o-tolyl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]prop-2-en-1-one Formula: C20H20F3N3O MolecularWeight: 375.38751

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=CC(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C20H20F3N3O/c1-15-4-2-3-5-16(15)6-9-19(27)26-12-10-25(11-13-26)18-8-7-17(14-24-18)20(21,22)23/h2-9,14H,10-13H2,1H3/b9-6+