5-[4-(3-fluoranyl-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-(4-methylpent-3-enoxy)benzoic acid

Systemtic Name: 5-[4-(3-fluoranyl-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-(4-methylpent-3-enoxy)benzoic acid Openeye Name: 5-[4-(3-fluoro-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-(4-methylpent-3-enoxy)benzoic acid CAS Name: 5-[4-(3-fluoro-4-methylsulfonyloxyphenyl)-2,5-dimethoxyphenyl]-2-(4-methylpent-3-enoxy)benzoic acid IUPAC Name: 5-[4-(3-fluoro-4-methylsulfonyloxyphenyl)-2,5-dimethoxyphenyl]-2-(4-methylpent-3-enoxy)benzoic acid Traditional Name: 5-[4-(3-fluoro-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-(4-methylpent-3-enoxy)benzoic acid Formula: C28H29FO8S MolecularWeight: 544.588463

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2OC)C3=CC(=C(C=C3)OS(=O)(=O)C)F)OC)C(=O)O)C

Isomeric SMILES

CC(=CCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2OC)C3=CC(=C(C=C3)OS(=O)(=O)C)F)OC)C(=O)O)C

InChI

InChI=1S/C28H29FO8S/c1-17(2)7-6-12-36-24-10-8-18(13-22(24)28(30)31)20-15-27(35-4)21(16-26(20)34-3)19-9-11-25(23(29)14-19)37-38(5,32)33/h7-11,13-16H,6,12H2,1-5H3,(H,30,31)