disodium octadecane disulfate

Systemtic Name: disodium octadecane disulfate Openeye Name: disodium octadecane disulfate CAS Name: disodium octadecane disulfate IUPAC Name: disodium octadecane disulfate Traditional Name: disodium octadecane disulfate Formula: C18H38Na2O8S2-2 MolecularWeight: 492.59906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H38.2Na.2H2O4S/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;2*1-5(2,3)4/h3-18H2,1-2H3;;;2*(H2,1,2,3,4)/q;2*+1;;/p-4