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

Systemtic Name: 2-cyano-2-(2-methylphenyl)-2-[3-(thiophen-3-ylmethoxy)phenoxy]ethanoic acid Openeye Name: 2-cyano-2-(o-tolyl)-2-[3-(3-thienylmethoxy)phenoxy]acetic acid CAS Name: 2-cyano-2-(2-methylphenyl)-2-[3-(3-thiophenylmethoxy)phenoxy]acetic acid IUPAC Name: 2-cyano-2-(2-methylphenyl)-2-[3-(thiophen-3-ylmethoxy)phenoxy]acetic acid Traditional Name: 2-cyano-2-(o-tolyl)-2-[3-(3-thenyloxy)phenoxy]acetic acid Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1C(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

InChI

InChI=1S/C21H17NO4S/c1-15-5-2-3-8-19(15)21(14-22,20(23)24)26-18-7-4-6-17(11-18)25-12-16-9-10-27-13-16/h2-11,13H,12H2,1H3,(H,23,24)