[(4S)-5-(4-methylphenyl)sulfonyloxy-4-phenylmethoxy-pentyl] 4-methylbenzenesulfonate

Systemtic Name: [(4S)-5-(4-methylphenyl)sulfonyloxy-4-phenylmethoxy-pentyl] 4-methylbenzenesulfonate Openeye Name: [(4S)-4-benzyloxy-5-(p-tolylsulfonyloxy)pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(4S)-5-(4-methylphenyl)sulfonyloxy-4-phenylmethoxypentyl] ester IUPAC Name: [(4S)-5-(4-methylphenyl)sulfonyloxy-4-phenylmethoxypentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(4S)-4-benzoxy-5-tosyloxy-pentyl] ester Formula: C26H30O7S2 MolecularWeight: 518.6422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(COS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC[C@@H](COS(=O)(=O)C2=CC=C(C=C2)C)OCC3=CC=CC=C3

InChI

InChI=1S/C26H30O7S2/c1-21-10-14-25(15-11-21)34(27,28)32-18-6-9-24(31-19-23-7-4-3-5-8-23)20-33-35(29,30)26-16-12-22(2)13-17-26/h3-5,7-8,10-17,24H,6,9,18-20H2,1-2H3/t24-/m0/s1