2-[3-[2-fluoranyl-4-(phenylsulfonyl)phenoxy]-5-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[3-[2-fluoranyl-4-(phenylsulfonyl)phenoxy]-5-methyl-phenyl]ethanoic acid Openeye Name: 2-[3-[4-(benzenesulfonyl)-2-fluoro-phenoxy]-5-methyl-phenyl]acetic acid CAS Name: 2-[3-[4-(benzenesulfonyl)-2-fluorophenoxy]-5-methylphenyl]acetic acid IUPAC Name: 2-[3-[4-(benzenesulfonyl)-2-fluorophenoxy]-5-methylphenyl]acetic acid Traditional Name: 2-[3-(4-besyl-2-fluoro-phenoxy)-5-methyl-phenyl]acetic acid Formula: C21H17FO5S MolecularWeight: 400.420083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)F)CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC=C3)F)CC(=O)O

InChI

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