[(2S)-2-[3-(methoxymethoxy)phenyl]-2-oxidanyl-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-2-[3-(methoxymethoxy)phenyl]-2-oxidanyl-ethyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-2-hydroxy-2-[3-(methoxymethoxy)phenyl]ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-2-hydroxy-2-[3-(methoxymethoxy)phenyl]ethyl] ester IUPAC Name: [(2S)-2-hydroxy-2-[3-(methoxymethoxy)phenyl]ethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-2-hydroxy-2-[3-(methoxymethoxy)phenyl]ethyl] ester Formula: C17H20O6S MolecularWeight: 352.4021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC(=CC=C2)OCOC)O

Isomeric SMILES

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

InChI

InChI=1S/C17H20O6S/c1-13-6-8-16(9-7-13)24(19,20)23-11-17(18)14-4-3-5-15(10-14)22-12-21-2/h3-10,17-18H,11-12H2,1-2H3/t17-/m1/s1