2-[bis(2-hydroxyethyl)amino]ethanol; propyl 10-sulfooxyoctadecanoate

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; propyl 10-sulfooxyoctadecanoate Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; propyl 10-sulfooxyoctadecanoate CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 10-sulfooxyoctadecanoic acid propyl ester IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; propyl 10-sulfooxyoctadecanoate Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 10-sulfoxystearic acid propyl ester Formula: C27H57NO9S MolecularWeight: 571.80778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCCC(=O)OCCC)OS(=O)(=O)O.C(CO)N(CCO)CCO

Isomeric SMILES

CCCCCCCCC(CCCCCCCCC(=O)OCCC)OS(=O)(=O)O.C(CO)N(CCO)CCO

InChI

InChI=1S/C21H42O6S.C6H15NO3/c1-3-5-6-7-10-13-16-20(27-28(23,24)25)17-14-11-8-9-12-15-18-21(22)26-19-4-2;8-4-1-7(2-5-9)3-6-10/h20H,3-19H2,1-2H3,(H,23,24,25);8-10H,1-6H2