methyl 2-nitro-5-[2-(trifluoromethyl)-4-(trifluoromethylsulfonyl)phenoxy]benzoate

Systemtic Name: methyl 2-nitro-5-[2-(trifluoromethyl)-4-(trifluoromethylsulfonyl)phenoxy]benzoate Openeye Name: methyl 2-nitro-5-[2-(trifluoromethyl)-4-(trifluoromethylsulfonyl)phenoxy]benzoate CAS Name: 2-nitro-5-[2-(trifluoromethyl)-4-(trifluoromethylsulfonyl)phenoxy]benzoic acid methyl ester IUPAC Name: methyl 2-nitro-5-[2-(trifluoromethyl)-4-(trifluoromethylsulfonyl)phenoxy]benzoate Traditional Name: 2-nitro-5-[2-(trifluoromethyl)-4-triflyl-phenoxy]benzoic acid methyl ester Formula: C16H9F6NO7S MolecularWeight: 473.300579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9F6NO7S/c1-29-14(24)10-6-8(2-4-12(10)23(25)26)30-13-5-3-9(7-11(13)15(17,18)19)31(27,28)16(20,21)22/h2-7H,1H3