2-[2-(5-cyano-2-phenylmethoxy-phenoxy)-3,5,6-tris(fluoranyl)pyridin-4-yl]oxy-3-methoxy-benzoic acid

Systemtic Name: 2-[2-(5-cyano-2-phenylmethoxy-phenoxy)-3,5,6-tris(fluoranyl)pyridin-4-yl]oxy-3-methoxy-benzoic acid Openeye Name: 2-[[2-(2-benzyloxy-5-cyano-phenoxy)-3,5,6-trifluoro-4-pyridyl]oxy]-3-methoxy-benzoic acid CAS Name: 2-[[2-(5-cyano-2-phenylmethoxyphenoxy)-3,5,6-trifluoro-4-pyridinyl]oxy]-3-methoxybenzoic acid IUPAC Name: 2-[2-(5-cyano-2-phenylmethoxyphenoxy)-3,5,6-trifluoropyridin-4-yl]oxy-3-methoxybenzoic acid Traditional Name: 2-[[2-(2-benzoxy-5-cyano-phenoxy)-3,5,6-trifluoro-4-pyridyl]oxy]-3-methoxy-benzoic acid Formula: C27H17F3N2O6 MolecularWeight: 522.42889

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC2=C(C(=NC(=C2F)F)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4)F)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC2=C(C(=NC(=C2F)F)OC3=C(C=CC(=C3)C#N)OCC4=CC=CC=C4)F)C(=O)O

InChI

InChI=1S/C27H17F3N2O6/c1-35-19-9-5-8-17(27(33)34)23(19)38-24-21(28)25(30)32-26(22(24)29)37-20-12-16(13-31)10-11-18(20)36-14-15-6-3-2-4-7-15/h2-12H,14H2,1H3,(H,33,34)