(2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]butane-1,3-diol

Systemtic Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]butane-1,3-diol Openeye Name: (2S,3R)-2-(p-tolylsulfonylmethyl)butane-1,3-diol CAS Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]butane-1,3-diol IUPAC Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]butane-1,3-diol Traditional Name: (2S,3R)-2-(tosylmethyl)butane-1,3-diol Formula: C12H18O4S MolecularWeight: 258.33392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(CO)C(C)O

Isomeric SMILES

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

InChI

InChI=1S/C12H18O4S/c1-9-3-5-12(6-4-9)17(15,16)8-11(7-13)10(2)14/h3-6,10-11,13-14H,7-8H2,1-2H3/t10-,11-/m1/s1