3,4,5-tris[(2-fluorophenyl)methoxy]benzoic acid

Systemtic Name: 3,4,5-tris[(2-fluorophenyl)methoxy]benzoic acid Openeye Name: 3,4,5-tris[(2-fluorophenyl)methoxy]benzoic acid CAS Name: 3,4,5-tris[(2-fluorophenyl)methoxy]benzoic acid IUPAC Name: 3,4,5-tris[(2-fluorophenyl)methoxy]benzoic acid Traditional Name: 3,4,5-tris[(2-fluorobenzyl)oxy]benzoic acid Formula: C28H21F3O5 MolecularWeight: 494.45855

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC(=CC(=C2OCC3=CC=CC=C3F)OCC4=CC=CC=C4F)C(=O)O)F

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC(=CC(=C2OCC3=CC=CC=C3F)OCC4=CC=CC=C4F)C(=O)O)F

InChI

InChI=1S/C28H21F3O5/c29-22-10-4-1-7-18(22)15-34-25-13-21(28(32)33)14-26(35-16-19-8-2-5-11-23(19)30)27(25)36-17-20-9-3-6-12-24(20)31/h1-14H,15-17H2,(H,32,33)