[3,5-bis(hydroxymethyl)phenyl] hexadecane-1-sulfonate

Systemtic Name: [3,5-bis(hydroxymethyl)phenyl] hexadecane-1-sulfonate Openeye Name: [3,5-bis(hydroxymethyl)phenyl] hexadecane-1-sulfonate CAS Name: 1-hexadecanesulfonic acid IUPAC Name: [3,5-bis(hydroxymethyl)phenyl] hexadecane-1-sulfonate Traditional Name: hexadecane-1-sulfonic acid (3,5-dimethylolphenyl) ester Formula: C24H42O5S MolecularWeight: 442.65228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)OC1=CC(=CC(=C1)CO)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)OC1=CC(=CC(=C1)CO)CO

InChI

InChI=1S/C24H42O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-30(27,28)29-24-18-22(20-25)17-23(19-24)21-26/h17-19,25-26H,2-16,20-21H2,1H3