4-[[5-(2-methyl-5-nitro-phenyl)furan-2-yl]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 4-[[5-(2-methyl-5-nitro-phenyl)furan-2-yl]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-[[5-(2-methyl-5-nitro-phenyl)-2-furyl]methylene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one CAS Name: 4-[[5-(2-methyl-5-nitrophenyl)-2-furanyl]methylidene]-2-phenyl-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 4-[[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 4-[[5-(2-methyl-5-nitro-phenyl)-2-furyl]methylene]-2-phenyl-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C22H14F3N3O4 MolecularWeight: 441.35947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H14F3N3O4/c1-13-7-8-15(28(30)31)11-17(13)19-10-9-16(32-19)12-18-20(22(23,24)25)26-27(21(18)29)14-5-3-2-4-6-14/h2-12H,1H3