2-(2-chlorophenyl)-2-[2-cyano-3-fluoranyl-5-(thiophen-3-ylmethoxy)phenoxy]ethanoic acid

Systemtic Name: 2-(2-chlorophenyl)-2-[2-cyano-3-fluoranyl-5-(thiophen-3-ylmethoxy)phenoxy]ethanoic acid Openeye Name: 2-(2-chlorophenyl)-2-[2-cyano-3-fluoro-5-(3-thienylmethoxy)phenoxy]acetic acid CAS Name: 2-(2-chlorophenyl)-2-[2-cyano-3-fluoro-5-(3-thiophenylmethoxy)phenoxy]acetic acid IUPAC Name: 2-(2-chlorophenyl)-2-[2-cyano-3-fluoro-5-(thiophen-3-ylmethoxy)phenoxy]acetic acid Traditional Name: 2-(2-chlorophenyl)-2-[2-cyano-3-fluoro-5-(3-thenyloxy)phenoxy]acetic acid Formula: C20H13ClFNO4S MolecularWeight: 417.837923

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=CSC=C3)F)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)O)OC2=C(C(=CC(=C2)OCC3=CSC=C3)F)C#N)Cl

InChI

InChI=1S/C20H13ClFNO4S/c21-16-4-2-1-3-14(16)19(20(24)25)27-18-8-13(7-17(22)15(18)9-23)26-10-12-5-6-28-11-12/h1-8,11,19H,10H2,(H,24,25)