tert-butyl (4R,5R)-4,5-bis-(4-methylphenyl)sulfonyloxyheptanoate

Systemtic Name: tert-butyl (4R,5R)-4,5-bis-(4-methylphenyl)sulfonyloxyheptanoate Openeye Name: tert-butyl (4R,5R)-4,5-bis(p-tolylsulfonyloxy)heptanoate CAS Name: (4R,5R)-4,5-bis-(4-methylphenyl)sulfonyloxyheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5R)-4,5-bis-(4-methylphenyl)sulfonyloxyheptanoate Traditional Name: (4R,5R)-4,5-ditosyloxyenanthic acid tert-butyl ester Formula: C25H34O8S2 MolecularWeight: 526.66266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCC(=O)OC(C)(C)C)OS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC[C@H]([C@@H](CCC(=O)OC(C)(C)C)OS(=O)(=O)C1=CC=C(C=C1)C)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C25H34O8S2/c1-7-22(32-34(27,28)20-12-8-18(2)9-13-20)23(16-17-24(26)31-25(4,5)6)33-35(29,30)21-14-10-19(3)11-15-21/h8-15,22-23H,7,16-17H2,1-6H3/t22-,23-/m1/s1