2-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]-2-methoxy-ethanoic acid

Systemtic Name: 2-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]-2-methoxy-ethanoic acid Openeye Name: 2-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]-2-methoxy-acetic acid CAS Name: 2-[5-[[4-chloro-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]-2-nitrophenoxy]-2-methoxyacetic acid IUPAC Name: 2-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitrophenoxy]-2-methoxyacetic acid Traditional Name: 2-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenoxy]-2-methoxy-acetic acid Formula: C14H11ClF3N3O7 MolecularWeight: 425.70125

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)OC2=CC(=C(C=C2)[N+](=O)[O-])OC(C(=O)O)OC)Cl)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)OC2=CC(=C(C=C2)[N+](=O)[O-])OC(C(=O)O)OC)Cl)C(F)(F)F

InChI

InChI=1S/C14H11ClF3N3O7/c1-20-10(14(16,17)18)9(15)11(19-20)27-6-3-4-7(21(24)25)8(5-6)28-13(26-2)12(22)23/h3-5,13H,1-2H3,(H,22,23)