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

Systemtic Name: tert-butyl 6-[[4-(4-acetyloxy-3-methoxy-phenyl)phenoxy]methyl]-2-oxidanyl-3-(trifluoromethyl)benzoate Openeye Name: tert-butyl 6-[[4-(4-acetoxy-3-methoxy-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate CAS Name: 6-[[4-(4-acetyloxy-3-methoxyphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 6-[[4-(4-acetyloxy-3-methoxyphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate Traditional Name: 6-[[4-(4-acetoxy-3-methoxy-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester Formula: C28H27F3O7 MolecularWeight: 532.50499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)C(F)(F)F)O)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C2=CC=C(C=C2)OCC3=C(C(=C(C=C3)C(F)(F)F)O)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C28H27F3O7/c1-16(32)37-22-13-9-18(14-23(22)35-5)17-6-10-20(11-7-17)36-15-19-8-12-21(28(29,30)31)25(33)24(19)26(34)38-27(2,3)4/h6-14,33H,15H2,1-5H3