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

Systemtic Name: 4-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-[[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methylene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one CAS Name: 4-[[5-(4-methoxy-2-nitrophenyl)-2-furanyl]methylidene]-2-phenyl-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 4-[[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 4-[[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methylene]-2-phenyl-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C22H14F3N3O5 MolecularWeight: 457.35887

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H14F3N3O5/c1-32-14-7-9-16(18(12-14)28(30)31)19-10-8-15(33-19)11-17-20(22(23,24)25)26-27(21(17)29)13-5-3-2-4-6-13/h2-12H,1H3