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

Systemtic Name: 4-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione Openeye Name: 4-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione CAS Name: 4-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione IUPAC Name: 4-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione Traditional Name: 4-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-quinone Formula: C31H19F3N4O2 MolecularWeight: 536.50337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C4C5=CC=CC=C5C(=O)N(C4=O)C6=CC=CC(=C6)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=C4C5=CC=CC=C5C(=O)N(C4=O)C6=CC=CC(=C6)C(F)(F)F

InChI

InChI=1S/C31H19F3N4O2/c32-31(33,34)22-9-6-12-24(17-22)38-29(39)26-14-5-4-13-25(26)27(30(38)40)16-21-19-37(23-10-2-1-3-11-23)36-28(21)20-8-7-15-35-18-20/h1-19H