3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxy-2-nitro-benzoic acid

Systemtic Name: 3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxy-2-nitro-benzoic acid Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]-2-nitro-benzoic acid CAS Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]-2-nitrobenzoic acid IUPAC Name: 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy-2-nitrobenzoic acid Traditional Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]-2-nitro-benzoic acid Formula: C13H6ClF3N2O5 MolecularWeight: 362.64535

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H6ClF3N2O5/c14-8-4-6(13(15,16)17)5-18-11(8)24-9-3-1-2-7(12(20)21)10(9)19(22)23/h1-5H,(H,20,21)