2-chloranyl-5-[4-[(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzoate

Systemtic Name: 2-chloranyl-5-[4-[(3-ethoxy-5-nitro-4-oxidanidyl-phenyl)methylidene]-5-oxidanylidene-3-(trifluoromethyl)pyrazol-1-yl]benzoate Openeye Name: 2-chloro-5-[4-[(3-ethoxy-5-nitro-4-oxido-phenyl)methylene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzoate CAS Name: 2-chloro-5-[4-[(3-ethoxy-5-nitro-4-oxidophenyl)methylidene]-5-oxo-3-(trifluoromethyl)-1-pyrazolyl]benzoate IUPAC Name: 2-chloro-5-[4-[(3-ethoxy-5-nitro-4-oxidophenyl)methylidene]-5-oxo-3-(trifluoromethyl)pyrazol-1-yl]benzoate Traditional Name: 2-chloro-5-[4-(3-ethoxy-5-nitro-4-oxido-benzylidene)-5-keto-3-(trifluoromethyl)-2-pyrazolin-1-yl]benzoate Formula: C20H11ClF3N3O7-2 MolecularWeight: 497.76545

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=NN(C2=O)C3=CC(=C(C=C3)Cl)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=NN(C2=O)C3=CC(=C(C=C3)Cl)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C20H13ClF3N3O7/c1-2-34-15-7-9(6-14(16(15)28)27(32)33)5-12-17(20(22,23)24)25-26(18(12)29)10-3-4-13(21)11(8-10)19(30)31/h3-8,28H,2H2,1H3,(H,30,31)/p-2