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

Systemtic Name: 2-[4-[3,3-bis(4-methylsulfonyloxyphenyl)prop-2-enylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3,3-bis(4-methylsulfonyloxyphenyl)allylsulfanyl]phenoxy]acetic acid CAS Name: 2-[4-[3,3-bis(4-methylsulfonyloxyphenyl)prop-2-enylthio]phenoxy]acetic acid IUPAC Name: 2-[4-[3,3-bis(4-methylsulfonyloxyphenyl)prop-2-enylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[3,3-bis(4-methylsulfonyloxyphenyl)allylthio]phenoxy]acetic acid Formula: C25H24O9S3 MolecularWeight: 564.64766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C25H24O9S3/c1-36(28,29)33-21-7-3-18(4-8-21)24(19-5-9-22(10-6-19)34-37(2,30)31)15-16-35-23-13-11-20(12-14-23)32-17-25(26)27/h3-15H,16-17H2,1-2H3,(H,26,27)