3-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-nitro-benzoic acid

Systemtic Name: 3-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-nitro-benzoic acid Openeye Name: 3-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-nitro-benzoic acid CAS Name: 3-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-nitrobenzoic acid IUPAC Name: 3-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-nitrobenzoic acid Traditional Name: 3-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-nitro-benzoic acid Formula: C14H7ClF3NO5 MolecularWeight: 361.65729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1F)Cl)OC2=CC=CC(=C2[N+](=O)[O-])C(=O)O)F)F

Isomeric SMILES

CC1=C(C(=C(C(=C1F)Cl)OC2=CC=CC(=C2[N+](=O)[O-])C(=O)O)F)F

InChI

InChI=1S/C14H7ClF3NO5/c1-5-9(16)8(15)13(11(18)10(5)17)24-7-4-2-3-6(14(20)21)12(7)19(22)23/h2-4H,1H3,(H,20,21)