2-[4-[3,3-bis(3-fluorophenyl)prop-2-enylsulfanyl]-2-iodanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3,3-bis(3-fluorophenyl)prop-2-enylsulfanyl]-2-iodanyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[3,3-bis(3-fluorophenyl)allylsulfanyl]-2-iodo-phenoxy]acetic acid CAS Name: 2-[4-[3,3-bis(3-fluorophenyl)prop-2-enylthio]-2-iodophenoxy]acetic acid IUPAC Name: 2-[4-[3,3-bis(3-fluorophenyl)prop-2-enylsulfanyl]-2-iodophenoxy]acetic acid Traditional Name: 2-[4-[3,3-bis(3-fluorophenyl)allylthio]-2-iodo-phenoxy]acetic acid Formula: C23H17F2IO3S MolecularWeight: 538.345556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=CCSC2=CC(=C(C=C2)OCC(=O)O)I)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=CCSC2=CC(=C(C=C2)OCC(=O)O)I)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H17F2IO3S/c24-17-5-1-3-15(11-17)20(16-4-2-6-18(25)12-16)9-10-30-19-7-8-22(21(26)13-19)29-14-23(27)28/h1-9,11-13H,10,14H2,(H,27,28)