[4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-oxidanyl-4-phenylmethoxy-phenyl)phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-oxidanyl-4-phenylmethoxy-phenyl)phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-hydroxy-phenyl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[4-(3-hydroxy-4-phenylmethoxyphenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-hydroxy-phenyl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]phenyl] ester Formula: C29H28O10S2 MolecularWeight: 600.65662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)O)OC)OS(=O)(=O)C)C4=CC=C(C=C4)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)O)OC)OS(=O)(=O)C)C4=CC=C(C=C4)OS(=O)(=O)C

InChI

InChI=1S/C29H28O10S2/c1-35-26-17-23(21-12-15-25(24(30)16-21)37-18-19-8-6-5-7-9-19)28(36-2)29(39-41(4,33)34)27(26)20-10-13-22(14-11-20)38-40(3,31)32/h5-17,30H,18H2,1-4H3