2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxy-phenoxy]acetic acid CAS Name: 2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxyphenoxy]acetic acid IUPAC Name: 2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxyphenoxy]acetic acid Traditional Name: 2-[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(4-methylsulfonyloxyphenyl)phenyl]-2-methylsulfonyloxy-phenoxy]acetic acid Formula: C25H26O14S3 MolecularWeight: 646.66054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC(=O)O)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC(=O)O)OS(=O)(=O)C

InChI

InChI=1S/C25H26O14S3/c1-34-21-13-18(15-6-9-17(10-7-15)37-40(3,28)29)24(35-2)25(39-42(5,32)33)23(21)16-8-11-19(36-14-22(26)27)20(12-16)38-41(4,30)31/h6-13H,14H2,1-5H3,(H,26,27)