[5-(4-bromanyl-3,6-dimethoxy-2-methylsulfonyloxy-phenyl)-2-phenylmethoxy-phenyl] methanesulfonate

Systemtic Name: [5-(4-bromanyl-3,6-dimethoxy-2-methylsulfonyloxy-phenyl)-2-phenylmethoxy-phenyl] methanesulfonate Openeye Name: [2-benzyloxy-5-(4-bromo-3,6-dimethoxy-2-methylsulfonyloxy-phenyl)phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-(4-bromo-3,6-dimethoxy-2-methylsulfonyloxyphenyl)-2-phenylmethoxyphenyl] ester IUPAC Name: [5-(4-bromo-3,6-dimethoxy-2-methylsulfonyloxyphenyl)-2-phenylmethoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-benzoxy-5-(4-bromo-3,6-dimethoxy-2-methylsulfonyloxy-phenyl)phenyl] ester Formula: C23H23BrO9S2 MolecularWeight: 587.45732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OS(=O)(=O)C)OS(=O)(=O)C)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OS(=O)(=O)C)OS(=O)(=O)C)OC)Br

InChI

InChI=1S/C23H23BrO9S2/c1-29-20-13-17(24)22(30-2)23(33-35(4,27)28)21(20)16-10-11-18(19(12-16)32-34(3,25)26)31-14-15-8-6-5-7-9-15/h5-13H,14H2,1-4H3