disodium 1-decoxydecane sulfate

Systemtic Name: disodium 1-decoxydecane sulfate Openeye Name: disodium 1-decoxydecane sulfate CAS Name: disodium 1-decoxydecane sulfate IUPAC Name: disodium 1-decoxydecane sulfate Traditional Name: disodium 1-decoxydecane sulfate Formula: C20H42Na2O5S MolecularWeight: 440.58902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCOCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H42O.2Na.H2O4S/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2;;;1-5(2,3)4/h3-20H2,1-2H3;;;(H2,1,2,3,4)/q;2*+1;/p-2