[4-ethanoyl-3,5-bis-(4-methylphenyl)sulfonyloxy-phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-ethanoyl-3,5-bis-(4-methylphenyl)sulfonyloxy-phenyl] 4-methylbenzenesulfonate Openeye Name: [4-acetyl-3,5-bis(p-tolylsulfonyloxy)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-acetyl-3,5-bis-(4-methylphenyl)sulfonyloxyphenyl] ester IUPAC Name: [4-acetyl-3,5-bis-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-acetyl-3,5-ditosyloxy-phenyl) ester Formula: C29H26O10S3 MolecularWeight: 630.70574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C(=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C(=O)C)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=C(C(=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C(=O)C)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H26O10S3/c1-19-5-11-24(12-6-19)40(31,32)37-23-17-27(38-41(33,34)25-13-7-20(2)8-14-25)29(22(4)30)28(18-23)39-42(35,36)26-15-9-21(3)10-16-26/h5-18H,1-4H3