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

Systemtic Name: 2-oxidanylethanoyl 5-[2-chloranyl-3,5,6-tris(fluoranyl)-4-methyl-phenoxy]-2-nitro-benzoate Openeye Name: (2-hydroxyacetyl) 5-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-nitro-benzoate CAS Name: 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-nitrobenzoic acid (2-hydroxy-1-oxoethyl) ester IUPAC Name: (2-hydroxyacetyl) 5-(2-chloro-3,5,6-trifluoro-4-methylphenoxy)-2-nitrobenzoate Traditional Name: 5-(2-chloro-3,5,6-trifluoro-4-methyl-phenoxy)-2-nitro-benzoic acid glycoloyl ester Formula: C16H9ClF3NO7 MolecularWeight: 419.69337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClF3NO7/c1-6-12(18)11(17)15(14(20)13(6)19)27-7-2-3-9(21(25)26)8(4-7)16(24)28-10(23)5-22/h2-4,22H,5H2,1H3