tert-butyl 6-[[4-(3-acetyloxy-2-methyl-phenyl)phenoxy]methyl]-2-oxidanyl-3-(trifluoromethyl)benzoate

Systemtic Name: tert-butyl 6-[[4-(3-acetyloxy-2-methyl-phenyl)phenoxy]methyl]-2-oxidanyl-3-(trifluoromethyl)benzoate Openeye Name: tert-butyl 6-[[4-(3-acetoxy-2-methyl-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate CAS Name: 6-[[4-(3-acetyloxy-2-methylphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 6-[[4-(3-acetyloxy-2-methylphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate Traditional Name: 6-[[4-(3-acetoxy-2-methyl-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester Formula: C28H27F3O6 MolecularWeight: 516.50559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OC(=O)C)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)C(F)(F)F)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1OC(=O)C)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)C(F)(F)F)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H27F3O6/c1-16-21(7-6-8-23(16)36-17(2)32)18-9-12-20(13-10-18)35-15-19-11-14-22(28(29,30)31)25(33)24(19)26(34)37-27(3,4)5/h6-14,33H,15H2,1-5H3