2-[5-(1,3-benzodioxol-5-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)ethanoic acid

Systemtic Name: 2-[5-(1,3-benzodioxol-5-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)ethanoic acid Openeye Name: 2-[5-(1,3-benzodioxol-5-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)acetic acid CAS Name: 2-[5-(1,3-benzodioxol-5-ylmethoxy)-2-cyanophenoxy]-2-(2-chlorophenyl)acetic acid IUPAC Name: 2-[5-(1,3-benzodioxol-5-ylmethoxy)-2-cyanophenoxy]-2-(2-chlorophenyl)acetic acid Traditional Name: 2-(2-chlorophenyl)-2-(2-cyano-5-piperonyloxy-phenoxy)acetic acid Formula: C23H16ClNO6 MolecularWeight: 437.82924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC3=CC(=C(C=C3)C#N)OC(C4=CC=CC=C4Cl)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC3=CC(=C(C=C3)C#N)OC(C4=CC=CC=C4Cl)C(=O)O

InChI

InChI=1S/C23H16ClNO6/c24-18-4-2-1-3-17(18)22(23(26)27)31-20-10-16(7-6-15(20)11-25)28-12-14-5-8-19-21(9-14)30-13-29-19/h1-10,22H,12-13H2,(H,26,27)