2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]ethanoate

Systemtic Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]ethanoate Openeye Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]acetate CAS Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]acetate IUPAC Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]acetate Traditional Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]acetate Formula: C21H14ClN2O4- MolecularWeight: 393.79986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)[O-])OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)[O-])OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N)Cl

InChI

InChI=1S/C21H15ClN2O4/c22-18-4-2-1-3-17(18)20(21(25)26)28-19-11-16(6-5-15(19)12-23)27-13-14-7-9-24-10-8-14/h1-11,20H,13H2,(H,25,26)/p-1