octadecane disulfate

Systemtic Name: octadecane disulfate Openeye Name: octadecane disulfate CAS Name: octadecane disulfate IUPAC Name: octadecane disulfate Traditional Name: octadecane disulfate Formula: C18H38O8S2-4 MolecularWeight: 446.61952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H38.2H2O4S/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)/p-4