sodium; 2-acetyloxydocosane-1-sulfonate; 2-(2-hydroxyethylazaniumyl)ethanolate

Systemtic Name: sodium; 2-acetyloxydocosane-1-sulfonate; 2-(2-hydroxyethylazaniumyl)ethanolate Openeye Name: sodium; 2-acetoxydocosane-1-sulfonate; 2-(2-hydroxyethylammonio)ethanolate CAS Name: sodium; 2-acetyloxy-1-docosanesulfonate; 2-(2-hydroxyethylammonio)ethanolate IUPAC Name: sodium; 2-acetyloxydocosane-1-sulfonate; 2-(2-hydroxyethylazaniumyl)ethanolate Traditional Name: sodium; 2-acetoxydocosane-1-sulfonate; 2-(2-hydroxyethylammonio)ethanolate Formula: C28H58NNaO7S MolecularWeight: 575.81739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(CS(=O)(=O)[O-])OC(=O)C.C(CO)[NH2+]CC[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(CS(=O)(=O)[O-])OC(=O)C.C(CO)[NH2+]CC[O-].[Na+]

InChI

InChI=1S/C24H48O5S.C4H10NO2.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(29-23(2)25)22-30(26,27)28;6-3-1-5-2-4-7;/h24H,3-22H2,1-2H3,(H,26,27,28);5-6H,1-4H2;/q;-1;+1