[4-[[3,5-dimethyl-4-(phenylsulfonyloxy)phenyl]-diphenyl-methyl]-2,6-dimethyl-phenyl] benzenesulfonate

Systemtic Name: [4-[[3,5-dimethyl-4-(phenylsulfonyloxy)phenyl]-diphenyl-methyl]-2,6-dimethyl-phenyl] benzenesulfonate Openeye Name: [4-[[4-(benzenesulfonyloxy)-3,5-dimethyl-phenyl]-diphenyl-methyl]-2,6-dimethyl-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-[[4-(benzenesulfonyloxy)-3,5-dimethylphenyl]-diphenylmethyl]-2,6-dimethylphenyl] ester IUPAC Name: [4-[[4-(benzenesulfonyloxy)-3,5-dimethylphenyl]-diphenylmethyl]-2,6-dimethylphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-[(4-besyloxy-3,5-dimethyl-phenyl)-diphenyl-methyl]-2,6-dimethyl-phenyl] ester Formula: C41H36O6S2 MolecularWeight: 688.85094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OS(=O)(=O)C2=CC=CC=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC(=C(C(=C5)C)OS(=O)(=O)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=CC(=C1OS(=O)(=O)C2=CC=CC=C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC(=C(C(=C5)C)OS(=O)(=O)C6=CC=CC=C6)C

InChI

InChI=1S/C41H36O6S2/c1-29-25-35(26-30(2)39(29)46-48(42,43)37-21-13-7-14-22-37)41(33-17-9-5-10-18-33,34-19-11-6-12-20-34)36-27-31(3)40(32(4)28-36)47-49(44,45)38-23-15-8-16-24-38/h5-28H,1-4H3