2-[2-[3-fluoranyl-4-(phenylsulfonyl)phenyl]-4-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[3-fluoranyl-4-(phenylsulfonyl)phenyl]-4-methyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[4-(benzenesulfonyl)-3-fluoro-phenyl]-4-methyl-phenoxy]acetic acid CAS Name: 2-[2-[4-(benzenesulfonyl)-3-fluorophenyl]-4-methylphenoxy]acetic acid IUPAC Name: 2-[2-[4-(benzenesulfonyl)-3-fluorophenyl]-4-methylphenoxy]acetic acid Traditional Name: 2-[2-(4-besyl-3-fluoro-phenyl)-4-methyl-phenoxy]acetic acid Formula: C21H17FO5S MolecularWeight: 400.420083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C21H17FO5S/c1-14-7-9-19(27-13-21(23)24)17(11-14)15-8-10-20(18(22)12-15)28(25,26)16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,23,24)