2-methyl-5-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-methyl-5-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-methyl-5-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-methyl-5-[oxo-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-methyl-5-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-methyl-5-[4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C20H17F3N4O3 MolecularWeight: 418.36919

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O3/c1-25-18(29)14-4-2-12(10-15(14)19(25)30)17(28)27-8-6-26(7-9-27)16-5-3-13(11-24-16)20(21,22)23/h2-5,10-11H,6-9H2,1H3