2-methyl-2-[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]sulfanyl-propanoic acid

Systemtic Name: 2-methyl-2-[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]sulfanyl-propanoic acid Openeye Name: 2-methyl-2-[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]sulfanyl-propanoic acid CAS Name: 2-methyl-2-[[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]thio]propanoic acid IUPAC Name: 2-methyl-2-[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]sulfanylpropanoic acid Traditional Name: 2-methyl-2-[[4-[2-[4-(4-methylsulfonyloxyphenyl)phenyl]ethoxy]phenyl]thio]propionic acid Formula: C25H26O6S2 MolecularWeight: 486.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCC2=CC=C(C=C2)C3=CC=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCC2=CC=C(C=C2)C3=CC=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C25H26O6S2/c1-25(2,24(26)27)32-23-14-12-21(13-15-23)30-17-16-18-4-6-19(7-5-18)20-8-10-22(11-9-20)31-33(3,28)29/h4-15H,16-17H2,1-3H3,(H,26,27)