3-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid

Systemtic Name: 3-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid Openeye Name: 3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid CAS Name: 3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid IUPAC Name: 3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid Traditional Name: 3-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid Formula: C14H7ClF3NO5 MolecularWeight: 361.65729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H7ClF3NO5/c15-9-6-7(14(16,17)18)4-5-10(9)24-11-3-1-2-8(13(20)21)12(11)19(22)23/h1-6H,(H,20,21)