4-[4-[3-(4-fluorophenyl)sulfonyl-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]butanoic acid

Systemtic Name: 4-[4-[3-(4-fluorophenyl)sulfonyl-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]butanoic acid Openeye Name: 4-[4-[3-(4-fluorophenyl)sulfonyl-4-hydroxy-phenoxy]-3,5-dimethyl-phenyl]butanoic acid CAS Name: 4-[4-[3-(4-fluorophenyl)sulfonyl-4-hydroxyphenoxy]-3,5-dimethylphenyl]butanoic acid IUPAC Name: 4-[4-[3-(4-fluorophenyl)sulfonyl-4-hydroxyphenoxy]-3,5-dimethylphenyl]butanoic acid Traditional Name: 4-[4-[3-(4-fluorophenyl)sulfonyl-4-hydroxy-phenoxy]-3,5-dimethyl-phenyl]butyric acid Formula: C24H23FO6S MolecularWeight: 458.499223

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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)C)CCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H23FO6S/c1-15-12-17(4-3-5-23(27)28)13-16(2)24(15)31-19-8-11-21(26)22(14-19)32(29,30)20-9-6-18(25)7-10-20/h6-14,26H,3-5H2,1-2H3,(H,27,28)