[2-methyl-3-(4-methylphenyl)sulfonyloxy-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methyl-3-(4-methylphenyl)sulfonyloxy-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate Openeye Name: [2-methyl-3-(p-tolylsulfonyloxy)-2-(p-tolylsulfonyloxymethyl)propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methyl-3-(4-methylphenyl)sulfonyloxy-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] ester IUPAC Name: [2-methyl-3-(4-methylphenyl)sulfonyloxy-2-[(4-methylphenyl)sulfonyloxymethyl]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methyl-3-tosyloxy-2-(tosyloxymethyl)propyl] ester Formula: C26H30O9S3 MolecularWeight: 582.706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(COS(=O)(=O)C2=CC=C(C=C2)C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C)(COS(=O)(=O)C2=CC=C(C=C2)C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H30O9S3/c1-20-5-11-23(12-6-20)36(27,28)33-17-26(4,18-34-37(29,30)24-13-7-21(2)8-14-24)19-35-38(31,32)25-15-9-22(3)10-16-25/h5-16H,17-19H2,1-4H3