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

Systemtic Name: [4-[4-(3-methanoyl-5-methylsulfonyloxy-4-phenylmethoxy-phenyl)-2,5-dimethoxy-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-formyl-5-methylsulfonyloxy-phenyl)-2,5-dimethoxy-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-(3-formyl-5-methylsulfonyloxy-4-phenylmethoxyphenyl)-2,5-dimethoxy-3-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[4-(3-formyl-5-methylsulfonyloxy-4-phenylmethoxyphenyl)-2,5-dimethoxy-3-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-formyl-5-methylsulfonyloxy-phenyl)-2,5-dimethoxy-3-methylsulfonyloxy-phenyl]phenyl] ester Formula: C31H30O13S3 MolecularWeight: 706.7571

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H30O13S3/c1-39-26-17-25(21-11-13-24(14-12-21)42-45(3,33)34)30(40-2)31(44-47(5,37)38)28(26)22-15-23(18-32)29(27(16-22)43-46(4,35)36)41-19-20-9-7-6-8-10-20/h6-18H,19H2,1-5H3