2-cyano-2-phenyl-2-[3-(pyridin-4-ylmethoxy)phenoxy]ethanoic acid

Systemtic Name: 2-cyano-2-phenyl-2-[3-(pyridin-4-ylmethoxy)phenoxy]ethanoic acid Openeye Name: 2-cyano-2-phenyl-2-[3-(4-pyridylmethoxy)phenoxy]acetic acid CAS Name: 2-cyano-2-phenyl-2-[3-(pyridin-4-ylmethoxy)phenoxy]acetic acid IUPAC Name: 2-cyano-2-phenyl-2-[3-(pyridin-4-ylmethoxy)phenoxy]acetic acid Traditional Name: 2-cyano-2-phenyl-2-[3-(4-pyridylmethoxy)phenoxy]acetic acid Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CC=NC=C3

InChI

InChI=1S/C21H16N2O4/c22-15-21(20(24)25,17-5-2-1-3-6-17)27-19-8-4-7-18(13-19)26-14-16-9-11-23-12-10-16/h1-13H,14H2,(H,24,25)