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

Systemtic Name: tert-butyl 6-[[4-(4-acetyloxy-2-propan-2-yl-phenyl)phenoxy]methyl]-2-oxidanyl-3-(trifluoromethyl)benzoate Openeye Name: tert-butyl 6-[[4-(4-acetoxy-2-isopropyl-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate CAS Name: 6-[[4-(4-acetyloxy-2-propan-2-ylphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 6-[[4-(4-acetyloxy-2-propan-2-ylphenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoate Traditional Name: 6-[[4-(4-acetoxy-2-isopropyl-phenyl)phenoxy]methyl]-2-hydroxy-3-(trifluoromethyl)benzoic acid tert-butyl ester Formula: C30H31F3O6 MolecularWeight: 544.55875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC(=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

CC(C)C1=C(C=CC(=C1)OC(=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/C30H31F3O6/c1-17(2)24-15-22(38-18(3)34)12-13-23(24)19-7-10-21(11-8-19)37-16-20-9-14-25(30(31,32)33)27(35)26(20)28(36)39-29(4,5)6/h7-15,17,35H,16H2,1-6H3