2-octyldodecyl 3-sulfooxypropanoate

Systemtic Name: 2-octyldodecyl 3-sulfooxypropanoate Openeye Name: 2-octyldodecyl 3-sulfooxypropanoate CAS Name: 3-sulfooxypropanoic acid 2-octyldodecyl ester IUPAC Name: 2-octyldodecyl 3-sulfooxypropanoate Traditional Name: 3-sulfoxypropionic acid 2-octyldodecyl ester Formula: C23H46O6S MolecularWeight: 450.67274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)COC(=O)CCOS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)COC(=O)CCOS(=O)(=O)O

InChI

InChI=1S/C23H46O6S/c1-3-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-4-2)21-28-23(24)19-20-29-30(25,26)27/h22H,3-21H2,1-2H3,(H,25,26,27)