[(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-oxidanyl-tridecyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-oxidanyl-tridecyl] 4-methylbenzenesulfonate Openeye Name: [(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-hydroxy-tridecyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-hydroxytridecyl] ester IUPAC Name: [(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-hydroxytridecyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-hydroxy-tridecyl] ester Formula: C36H52O5SSi MolecularWeight: 624.94558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(COS(=O)(=O)C1=CC=C(C=C1)C)O)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CCCCCCCCCC[C@@H]([C@@H](COS(=O)(=O)C1=CC=C(C=C1)C)O)O[Si](C2=CC=CC=C2)(C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C36H52O5SSi/c1-6-7-8-9-10-11-12-19-24-35(34(37)29-40-42(38,39)31-27-25-30(2)26-28-31)41-43(36(3,4)5,32-20-15-13-16-21-32)33-22-17-14-18-23-33/h13-18,20-23,25-28,34-35,37H,6-12,19,24,29H2,1-5H3/t34-,35+/m1/s1