[(1S,2S)-1-bis(phenylmethoxy)phosphoryl-1-(4-methylphenyl)sulfonyloxy-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [(1S,2S)-1-bis(phenylmethoxy)phosphoryl-1-(4-methylphenyl)sulfonyloxy-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [(1S,2S)-2-dibenzyloxyphosphoryl-1-methyl-2-(p-tolylsulfonyloxy)ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,2S)-1-bis(phenylmethoxy)phosphoryl-1-(4-methylphenyl)sulfonyloxypropan-2-yl] ester IUPAC Name: [(1S,2S)-1-bis(phenylmethoxy)phosphoryl-1-(4-methylphenyl)sulfonyloxypropan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,2S)-2-dibenzoxyphosphoryl-1-methyl-2-tosyloxy-ethyl] ester Formula: C31H33O9PS2 MolecularWeight: 644.692081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(OS(=O)(=O)C2=CC=C(C=C2)C)P(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H](C)[C@@H](OS(=O)(=O)C2=CC=C(C=C2)C)P(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C31H33O9PS2/c1-24-14-18-29(19-15-24)42(33,34)39-26(3)31(40-43(35,36)30-20-16-25(2)17-21-30)41(32,37-22-27-10-6-4-7-11-27)38-23-28-12-8-5-9-13-28/h4-21,26,31H,22-23H2,1-3H3/t26-,31-/m0/s1