[(3R)-1-phenyl-5-(phenylsulfonyl)pentan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(3R)-1-phenyl-5-(phenylsulfonyl)pentan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(1R)-1-[2-(benzenesulfonyl)ethyl]-3-phenyl-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-1-(benzenesulfonyl)-5-phenylpentan-3-yl] ester IUPAC Name: [(3R)-1-(benzenesulfonyl)-5-phenylpentan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1R)-1-(2-besylethyl)-3-phenyl-propyl] ester Formula: C24H26O5S2 MolecularWeight: 458.59024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(CCC2=CC=CC=C2)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](CCC2=CC=CC=C2)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H26O5S2/c1-20-12-16-24(17-13-20)31(27,28)29-22(15-14-21-8-4-2-5-9-21)18-19-30(25,26)23-10-6-3-7-11-23/h2-13,16-17,22H,14-15,18-19H2,1H3/t22-/m1/s1