hexadecyl benzenesulfonate

Systemtic Name: hexadecyl benzenesulfonate Openeye Name: hexadecyl benzenesulfonate CAS Name: benzenesulfonic acid hexadecyl ester IUPAC Name: hexadecyl benzenesulfonate Traditional Name: benzenesulfonic acid cetyl ester Formula: C22H38O3S MolecularWeight: 382.60032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C22H38O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-25-26(23,24)22-19-16-15-17-20-22/h15-17,19-20H,2-14,18,21H2,1H3