2-(hydroxymethyl)pentyl benzenesulfonate

Systemtic Name: 2-(hydroxymethyl)pentyl benzenesulfonate Openeye Name: 2-(hydroxymethyl)pentyl benzenesulfonate CAS Name: benzenesulfonic acid 2-(hydroxymethyl)pentyl ester IUPAC Name: 2-(hydroxymethyl)pentyl benzenesulfonate Traditional Name: benzenesulfonic acid 2-methylolpentyl ester Formula: C12H18O4S MolecularWeight: 258.33392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CO)COS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC(CO)COS(=O)(=O)C1=CC=CC=C1

InChI

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