[4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylsulfanyl)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylsulfanyl)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylsulfanyl)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylthio)-3-methylsulfonyloxyphenyl]-3-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylsulfanyl)-3-methylsulfonyloxyphenyl]-3-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[4-(3-methylbut-2-enylthio)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] ester Formula: C28H32O11S4 MolecularWeight: 672.80708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

Isomeric SMILES

CC(=CCSC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

InChI

InChI=1S/C28H32O11S4/c1-18(2)14-15-40-25-13-10-20(16-23(25)38-42(6,31)32)26-24(35-3)17-22(27(36-4)28(26)39-43(7,33)34)19-8-11-21(12-9-19)37-41(5,29)30/h8-14,16-17H,15H2,1-7H3