[(2S)-3-chloranyl-2-oxidanyl-propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-3-chloranyl-2-oxidanyl-propyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-3-chloro-2-hydroxy-propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-3-chloro-2-hydroxypropyl] ester IUPAC Name: [(2S)-3-chloro-2-hydroxypropyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-3-chloro-2-hydroxy-propyl] ester Formula: C10H13ClO4S MolecularWeight: 264.72582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCl)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](CCl)O

InChI

InChI=1S/C10H13ClO4S/c1-8-2-4-10(5-3-8)16(13,14)15-7-9(12)6-11/h2-5,9,12H,6-7H2,1H3/t9-/m1/s1