propan-2-yl 2-butyl-3-[3-(trifluoromethylsulfonyloxy)phenyl]carbonyl-1-benzofuran-5-carboxylate

Systemtic Name: propan-2-yl 2-butyl-3-[3-(trifluoromethylsulfonyloxy)phenyl]carbonyl-1-benzofuran-5-carboxylate Openeye Name: isopropyl 2-butyl-3-[3-(trifluoromethylsulfonyloxy)benzoyl]benzofuran-5-carboxylate CAS Name: 2-butyl-3-[oxo-[3-(trifluoromethylsulfonyloxy)phenyl]methyl]-5-benzofurancarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-butyl-3-[3-(trifluoromethylsulfonyloxy)benzoyl]-1-benzofuran-5-carboxylate Traditional Name: 2-butyl-3-(3-triflyloxybenzoyl)benzofuran-5-carboxylic acid isopropyl ester Formula: C24H23F3O7S MolecularWeight: 512.49543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC(C)C)C(=O)C3=CC(=CC=C3)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC(C)C)C(=O)C3=CC(=CC=C3)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C24H23F3O7S/c1-4-5-9-20-21(18-13-16(10-11-19(18)33-20)23(29)32-14(2)3)22(28)15-7-6-8-17(12-15)34-35(30,31)24(25,26)27/h6-8,10-14H,4-5,9H2,1-3H3