sodium [3-(16-methylheptadecoxy)-2-oxidanyl-propyl] sulfate

Systemtic Name: sodium [3-(16-methylheptadecoxy)-2-oxidanyl-propyl] sulfate Openeye Name: sodium [2-hydroxy-3-(16-methylheptadecoxy)propyl] sulfate CAS Name: sodium [2-hydroxy-3-(16-methylheptadecoxy)propyl] sulfate IUPAC Name: sodium [2-hydroxy-3-(16-methylheptadecoxy)propyl] sulfate Traditional Name: sodium [2-hydroxy-3-(16-methylheptadecoxy)propyl] sulfate Formula: C21H43NaO6S MolecularWeight: 446.61729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCCOCC(COS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCCOCC(COS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C21H44O6S.Na/c1-20(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-26-18-21(22)19-27-28(23,24)25;/h20-22H,3-19H2,1-2H3,(H,23,24,25);/q;+1/p-1