2-(2-chlorophenyl)-2-[2-cyano-5-(pyridazin-4-ylmethoxy)phenoxy]ethanoic acid

Systemtic Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridazin-4-ylmethoxy)phenoxy]ethanoic acid Openeye Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridazin-4-ylmethoxy)phenoxy]acetic acid CAS Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(4-pyridazinylmethoxy)phenoxy]acetic acid IUPAC Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridazin-4-ylmethoxy)phenoxy]acetic acid Traditional Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridazin-4-ylmethoxy)phenoxy]acetic acid Formula: C20H14ClN3O4 MolecularWeight: 395.79586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN3O4/c21-17-4-2-1-3-16(17)19(20(25)26)28-18-9-15(6-5-14(18)10-22)27-12-13-7-8-23-24-11-13/h1-9,11,19H,12H2,(H,25,26)