2-[3-fluoranyl-4-[3-(4-fluorophenyl)sulfonyl-4-oxidanyl-phenoxy]-5-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-fluoranyl-4-[3-(4-fluorophenyl)sulfonyl-4-oxidanyl-phenoxy]-5-methyl-phenoxy]ethanoic acid Openeye Name: 2-[3-fluoro-4-[3-(4-fluorophenyl)sulfonyl-4-hydroxy-phenoxy]-5-methyl-phenoxy]acetic acid CAS Name: 2-[3-fluoro-4-[3-(4-fluorophenyl)sulfonyl-4-hydroxyphenoxy]-5-methylphenoxy]acetic acid IUPAC Name: 2-[3-fluoro-4-[3-(4-fluorophenyl)sulfonyl-4-hydroxyphenoxy]-5-methylphenoxy]acetic acid Traditional Name: 2-[3-fluoro-4-[3-(4-fluorophenyl)sulfonyl-4-hydroxy-phenoxy]-5-methyl-phenoxy]acetic acid Formula: C21H16F2O7S MolecularWeight: 450.409346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)F)F)OCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)S(=O)(=O)C3=CC=C(C=C3)F)F)OCC(=O)O

InChI

InChI=1S/C21H16F2O7S/c1-12-8-15(29-11-20(25)26)9-17(23)21(12)30-14-4-7-18(24)19(10-14)31(27,28)16-5-2-13(22)3-6-16/h2-10,24H,11H2,1H3,(H,25,26)