[2-(hydroxymethyl)-3-methoxy-2-(methoxymethyl)propyl] benzenesulfonate

Systemtic Name: [2-(hydroxymethyl)-3-methoxy-2-(methoxymethyl)propyl] benzenesulfonate Openeye Name: [2-(hydroxymethyl)-3-methoxy-2-(methoxymethyl)propyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(hydroxymethyl)-3-methoxy-2-(methoxymethyl)propyl] ester IUPAC Name: [2-(hydroxymethyl)-3-methoxy-2-(methoxymethyl)propyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-hydroxy-2,2-bis(methoxymethyl)propyl] ester Formula: C13H20O6S MolecularWeight: 304.3593

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CO)(COC)COS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

COCC(CO)(COC)COS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H20O6S/c1-17-9-13(8-14,10-18-2)11-19-20(15,16)12-6-4-3-5-7-12/h3-7,14H,8-11H2,1-2H3