[5-[3,6-dimethoxy-4-(4-methylsulfanylphenyl)-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate

Systemtic Name: [5-[3,6-dimethoxy-4-(4-methylsulfanylphenyl)-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate Openeye Name: [5-[3,6-dimethoxy-4-(4-methylsulfanylphenyl)-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[3,6-dimethoxy-2-methylsulfonyloxy-4-[4-(methylthio)phenyl]phenyl]-2-(3-methylbut-2-enoxy)phenyl] ester IUPAC Name: [5-[3,6-dimethoxy-4-(4-methylsulfanylphenyl)-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[3,6-dimethoxy-2-methylsulfonyloxy-4-[4-(methylthio)phenyl]phenyl]-2-(3-methylbut-2-enoxy)phenyl] ester Formula: C28H32O9S3 MolecularWeight: 608.74328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)SC)OC)OS(=O)(=O)C)C

Isomeric SMILES

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)SC)OC)OS(=O)(=O)C)C

InChI

InChI=1S/C28H32O9S3/c1-18(2)14-15-35-23-13-10-20(16-24(23)36-39(6,29)30)26-25(33-3)17-22(19-8-11-21(38-5)12-9-19)27(34-4)28(26)37-40(7,31)32/h8-14,16-17H,15H2,1-7H3