ethyl hexadecanoate sulfate

Systemtic Name: ethyl hexadecanoate sulfate Openeye Name: ethyl hexadecanoate sulfate CAS Name: hexadecanoic acid ethyl ester sulfate IUPAC Name: ethyl hexadecanoate sulfate Traditional Name: palmitic acid ethyl ester sulfate Formula: C18H36O6S-2 MolecularWeight: 380.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C18H36O2.H2O4S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2;1-5(2,3)4/h3-17H2,1-2H3;(H2,1,2,3,4)/p-2