2-pyridin-2-yl-4-[[[2-(trifluoromethyl)phenyl]amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-pyridin-2-yl-4-[[[2-(trifluoromethyl)phenyl]amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2-pyridyl)-4-[[2-(trifluoromethyl)anilino]methylene]isoquinoline-1,3-dione CAS Name: 2-(2-pyridinyl)-4-[[2-(trifluoromethyl)anilino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-pyridin-2-yl-4-[[2-(trifluoromethyl)anilino]methylidene]isoquinoline-1,3-dione Traditional Name: 2-(2-pyridyl)-4-[[2-(trifluoromethyl)anilino]methylene]isoquinoline-1,3-quinone Formula: C22H14F3N3O2 MolecularWeight: 409.36067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=CC=CC=C3C(F)(F)F)C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC3=CC=CC=C3C(F)(F)F)C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H14F3N3O2/c23-22(24,25)17-9-3-4-10-18(17)27-13-16-14-7-1-2-8-15(14)20(29)28(21(16)30)19-11-5-6-12-26-19/h1-13,27H