[4-[3-methoxy-5-methylsulfonyloxy-4-(3-oxidanyl-4-phenylmethoxy-phenyl)phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[3-methoxy-5-methylsulfonyloxy-4-(3-oxidanyl-4-phenylmethoxy-phenyl)phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-hydroxy-phenyl)-3-methoxy-5-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-(3-hydroxy-4-phenylmethoxyphenyl)-3-methoxy-5-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[4-(3-hydroxy-4-phenylmethoxyphenyl)-3-methoxy-5-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-hydroxy-phenyl)-3-methoxy-5-methylsulfonyloxy-phenyl]phenyl] ester Formula: C28H26O9S2 MolecularWeight: 570.63064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C28H26O9S2/c1-34-26-16-22(20-9-12-23(13-10-20)36-38(2,30)31)17-27(37-39(3,32)33)28(26)21-11-14-25(24(29)15-21)35-18-19-7-5-4-6-8-19/h4-17,29H,18H2,1-3H3