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

Systemtic Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]pentane-1,3-diol Openeye Name: (2S,3R)-2-(p-tolylsulfonylmethyl)pentane-1,3-diol CAS Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]pentane-1,3-diol IUPAC Name: (2S,3R)-2-[(4-methylphenyl)sulfonylmethyl]pentane-1,3-diol Traditional Name: (2S,3R)-2-(tosylmethyl)pentane-1,3-diol Formula: C13H20O4S MolecularWeight: 272.3605

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CO)CS(=O)(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

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

InChI

InChI=1S/C13H20O4S/c1-3-13(15)11(8-14)9-18(16,17)12-6-4-10(2)5-7-12/h4-7,11,13-15H,3,8-9H2,1-2H3/t11-,13-/m1/s1