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

Systemtic Name: 2-[4-[3,3-bis(2-methylsulfonyloxyphenyl)prop-2-enylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3,3-bis(2-methylsulfonyloxyphenyl)allylsulfanyl]phenoxy]acetic acid CAS Name: 2-[4-[3,3-bis(2-methylsulfonyloxyphenyl)prop-2-enylthio]phenoxy]acetic acid IUPAC Name: 2-[4-[3,3-bis(2-methylsulfonyloxyphenyl)prop-2-enylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[3,3-bis(2-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=CC=C1C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=CC=C3OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC=C1C(=CCSC2=CC=C(C=C2)OCC(=O)O)C3=CC=CC=C3OS(=O)(=O)C

InChI

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