[(2R)-4-(4-chlorophenyl)-2-oxidanyl-butyl] 4-methylbenzenesulfonate

Systemtic Name: [(2R)-4-(4-chlorophenyl)-2-oxidanyl-butyl] 4-methylbenzenesulfonate Openeye Name: [(2R)-4-(4-chlorophenyl)-2-hydroxy-butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R)-4-(4-chlorophenyl)-2-hydroxybutyl] ester IUPAC Name: [(2R)-4-(4-chlorophenyl)-2-hydroxybutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R)-4-(4-chlorophenyl)-2-hydroxy-butyl] ester Formula: C17H19ClO4S MolecularWeight: 354.84836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](CCC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C17H19ClO4S/c1-13-2-10-17(11-3-13)23(20,21)22-12-16(19)9-6-14-4-7-15(18)8-5-14/h2-5,7-8,10-11,16,19H,6,9,12H2,1H3/t16-/m1/s1