2-[bis(2-hydroxyethyl)amino]ethanol; 1-sulfooxyoctadecan-9-yl hydrogen sulfate

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 1-sulfooxyoctadecan-9-yl hydrogen sulfate Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 9-sulfooxyoctadecyl hydrogen sulfate CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; sulfuric acid 1-sulfooxyoctadecan-9-yl ester IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; 1-sulfooxyoctadecan-9-yl hydrogen sulfate Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; sulfuric acid 9-sulfoxyoctadecyl ester Formula: C24H53NO11S2 MolecularWeight: 595.80772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCCOS(=O)(=O)O)OS(=O)(=O)O.C(CO)N(CCO)CCO

Isomeric SMILES

CCCCCCCCCC(CCCCCCCCOS(=O)(=O)O)OS(=O)(=O)O.C(CO)N(CCO)CCO

InChI

InChI=1S/C18H38O8S2.C6H15NO3/c1-2-3-4-5-6-9-12-15-18(26-28(22,23)24)16-13-10-7-8-11-14-17-25-27(19,20)21;8-4-1-7(2-5-9)3-6-10/h18H,2-17H2,1H3,(H,19,20,21)(H,22,23,24);8-10H,1-6H2