2-[4-[3-(4-ethanoyl-6-fluoranyl-3-oxidanyl-2-propyl-phenoxy)propylsulfonyl]phenyl]-3-methyl-4-oxidanyl-butanoic acid

Systemtic Name: 2-[4-[3-(4-ethanoyl-6-fluoranyl-3-oxidanyl-2-propyl-phenoxy)propylsulfonyl]phenyl]-3-methyl-4-oxidanyl-butanoic acid Openeye Name: 2-[4-[3-(4-acetyl-6-fluoro-3-hydroxy-2-propyl-phenoxy)propylsulfonyl]phenyl]-4-hydroxy-3-methyl-butanoic acid CAS Name: 2-[4-[3-(4-acetyl-6-fluoro-3-hydroxy-2-propylphenoxy)propylsulfonyl]phenyl]-4-hydroxy-3-methylbutanoic acid IUPAC Name: 2-[4-[3-(4-acetyl-6-fluoro-3-hydroxy-2-propylphenoxy)propylsulfonyl]phenyl]-4-hydroxy-3-methylbutanoic acid Traditional Name: 2-[4-[3-(4-acetyl-6-fluoro-3-hydroxy-2-propyl-phenoxy)propylsulfonyl]phenyl]-4-hydroxy-3-methyl-butyric acid Formula: C25H31FO8S MolecularWeight: 510.572243

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1OCCCS(=O)(=O)C2=CC=C(C=C2)C(C(C)CO)C(=O)O)F)C(=O)C)O

Isomeric SMILES

CCCC1=C(C(=CC(=C1OCCCS(=O)(=O)C2=CC=C(C=C2)C(C(C)CO)C(=O)O)F)C(=O)C)O

InChI

InChI=1S/C25H31FO8S/c1-4-6-19-23(29)20(16(3)28)13-21(26)24(19)34-11-5-12-35(32,33)18-9-7-17(8-10-18)22(25(30)31)15(2)14-27/h7-10,13,15,22,27,29H,4-6,11-12,14H2,1-3H3,(H,30,31)