[1,2,2-tris(3-fluorophenyl)cyclooctyl]oxyboronic acid

Systemtic Name: [1,2,2-tris(3-fluorophenyl)cyclooctyl]oxyboronic acid Openeye Name: [1,2,2-tris(3-fluorophenyl)cyclooctoxy]boronic acid CAS Name: [1,2,2-tris(3-fluorophenyl)cyclooctyl]oxyboronic acid IUPAC Name: [1,2,2-tris(3-fluorophenyl)cyclooctyl]oxyboronic acid Traditional Name: [1,2,2-tris(3-fluorophenyl)cyclooctoxy]boronic acid Formula: C26H26BF3O3 MolecularWeight: 454.28905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)OC1(CCCCCCC1(C2=CC(=CC=C2)F)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

Isomeric SMILES

B(O)(O)OC1(CCCCCCC1(C2=CC(=CC=C2)F)C3=CC(=CC=C3)F)C4=CC(=CC=C4)F

InChI

InChI=1S/C26H26BF3O3/c28-22-11-5-8-19(16-22)25(20-9-6-12-23(29)17-20)14-3-1-2-4-15-26(25,33-27(31)32)21-10-7-13-24(30)18-21/h5-13,16-18,31-32H,1-4,14-15H2