sodium 1-(2-ethylhexoxy)-1-oxidanylidene-tetradecane-2-sulfonate

Systemtic Name: sodium 1-(2-ethylhexoxy)-1-oxidanylidene-tetradecane-2-sulfonate Openeye Name: sodium 1-(2-ethylhexoxy)-1-oxo-tetradecane-2-sulfonate CAS Name: sodium 1-(2-ethylhexoxy)-1-oxo-2-tetradecanesulfonate IUPAC Name: sodium 1-(2-ethylhexoxy)-1-oxotetradecane-2-sulfonate Traditional Name: sodium 1-(2-ethylhexoxy)-1-keto-tetradecane-2-sulfonate Formula: C22H43NaO5S MolecularWeight: 442.62859

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C22H44O5S.Na/c1-4-7-9-10-11-12-13-14-15-16-18-21(28(24,25)26)22(23)27-19-20(6-3)17-8-5-2;/h20-21H,4-19H2,1-3H3,(H,24,25,26);/q;+1/p-1