ethyl 2-[2-[2-chloranyl-4-(trifluoromethyloxy)phenyl]-4-nitro-pyrazol-3-yl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[2-[2-chloranyl-4-(trifluoromethyloxy)phenyl]-4-nitro-pyrazol-3-yl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[2-[2-chloro-4-(trifluoromethoxy)phenyl]-4-nitro-pyrazol-3-yl]-2-oxo-acetate CAS Name: 2-[2-[2-chloro-4-(trifluoromethoxy)phenyl]-4-nitro-3-pyrazolyl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-chloro-4-(trifluoromethoxy)phenyl]-4-nitropyrazol-3-yl]-2-oxoacetate Traditional Name: 2-[2-[2-chloro-4-(trifluoromethoxy)phenyl]-4-nitro-pyrazol-3-yl]-2-keto-acetic acid ethyl ester Formula: C14H9ClF3N3O6 MolecularWeight: 407.68597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=C(C=NN1C2=C(C=C(C=C2)OC(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)C1=C(C=NN1C2=C(C=C(C=C2)OC(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClF3N3O6/c1-2-26-13(23)12(22)11-10(21(24)25)6-19-20(11)9-4-3-7(5-8(9)15)27-14(16,17)18/h3-6H,2H2,1H3