4-methylbenzenesulfonate; propane-1,2,3-triol

Systemtic Name: 4-methylbenzenesulfonate; propane-1,2,3-triol Openeye Name: glycerol; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; propane-1,2,3-triol IUPAC Name: 4-methylbenzenesulfonate; propane-1,2,3-triol Traditional Name: glycerol tosylate Formula: C10H15O6S- MolecularWeight: 263.2875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C(C(CO)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C(C(CO)O)O

InChI

InChI=1S/C7H8O3S.C3H8O3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3-6H,1-2H2/p-1