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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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