(2-tetradecylphenyl) 2-sulfooxyethanoate

Systemtic Name: (2-tetradecylphenyl) 2-sulfooxyethanoate Openeye Name: (2-tetradecylphenyl) 2-sulfooxyacetate CAS Name: 2-sulfooxyacetic acid (2-tetradecylphenyl) ester IUPAC Name: (2-tetradecylphenyl) 2-sulfooxyacetate Traditional Name: 2-sulfoxyacetic acid (2-myristylphenyl) ester Formula: C22H36O6S MolecularWeight: 428.58264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)COS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCC1=CC=CC=C1OC(=O)COS(=O)(=O)O

InChI

InChI=1S/C22H36O6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-20-17-14-15-18-21(20)28-22(23)19-27-29(24,25)26/h14-15,17-18H,2-13,16,19H2,1H3,(H,24,25,26)