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

Systemtic Name: 2-(2-chlorophenyl)-2-cyano-2-[3-(thiophen-3-ylmethoxy)phenoxy]ethanoic acid Openeye Name: 2-(2-chlorophenyl)-2-cyano-2-[3-(3-thienylmethoxy)phenoxy]acetic acid CAS Name: 2-(2-chlorophenyl)-2-cyano-2-[3-(3-thiophenylmethoxy)phenoxy]acetic acid IUPAC Name: 2-(2-chlorophenyl)-2-cyano-2-[3-(thiophen-3-ylmethoxy)phenoxy]acetic acid Traditional Name: 2-(2-chlorophenyl)-2-cyano-2-[3-(3-thenyloxy)phenoxy]acetic acid Formula: C20H14ClNO4S MolecularWeight: 399.84746

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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=CSC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClNO4S/c21-18-7-2-1-6-17(18)20(13-22,19(23)24)26-16-5-3-4-15(10-16)25-11-14-8-9-27-12-14/h1-10,12H,11H2,(H,23,24)