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

Systemtic Name: [4-[2,5-dimethoxy-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]-2-fluoranyl-phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-fluorophenyl] ester IUPAC Name: [4-[2,5-dimethoxy-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-fluorophenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl] ester Formula: C29H27FO9S2 MolecularWeight: 602.647683

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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)OC)C4=CC(=C(C=C4)OS(=O)(=O)C)F

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OS(=O)(=O)C)OC)C4=CC(=C(C=C4)OS(=O)(=O)C)F

InChI

InChI=1S/C29H27FO9S2/c1-35-27-17-23(28(36-2)16-22(27)20-10-12-25(24(30)14-20)38-40(3,31)32)21-11-13-26(29(15-21)39-41(4,33)34)37-18-19-8-6-5-7-9-19/h5-17H,18H2,1-4H3