2-(2-hydroxyethylamino)ethanol; 4-octadecoxy-4-oxidanylidene-2-sulfo-butanoic acid

Systemtic Name: 2-(2-hydroxyethylamino)ethanol; 4-octadecoxy-4-oxidanylidene-2-sulfo-butanoic acid Openeye Name: 2-(2-hydroxyethylamino)ethanol; 4-octadecoxy-4-oxo-2-sulfo-butanoic acid CAS Name: 2-(2-hydroxyethylamino)ethanol; 4-octadecoxy-4-oxo-2-sulfobutanoic acid IUPAC Name: 2-(2-hydroxyethylamino)ethanol; 4-octadecoxy-4-oxo-2-sulfobutanoic acid Traditional Name: 2-(2-hydroxyethylamino)ethanol; 4-keto-4-stearyloxy-2-sulfo-butyric acid Formula: C30H64N2O11S MolecularWeight: 660.90096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC(C(=O)O)S(=O)(=O)O.C(CO)NCCO.C(CO)NCCO

InChI

InChI=1S/C22H42O7S.2C4H11NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-29-21(23)19-20(22(24)25)30(26,27)28;2*6-3-1-5-2-4-7/h20H,2-19H2,1H3,(H,24,25)(H,26,27,28);2*5-7H,1-4H2