sodium 1-acetyloxyoctadecan-9-yl sulfate

Systemtic Name: sodium 1-acetyloxyoctadecan-9-yl sulfate Openeye Name: sodium 1-(8-acetoxyoctyl)decyl sulfate CAS Name: sodium 1-acetyloxyoctadecan-9-yl sulfate IUPAC Name: sodium 1-acetyloxyoctadecan-9-yl sulfate Traditional Name: sodium 1-(8-acetoxyoctyl)decyl sulfate Formula: C20H39NaO6S MolecularWeight: 430.57483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCCCOC(=O)C)OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCC(CCCCCCCCOC(=O)C)OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C20H40O6S.Na/c1-3-4-5-6-7-10-13-16-20(26-27(22,23)24)17-14-11-8-9-12-15-18-25-19(2)21;/h20H,3-18H2,1-2H3,(H,22,23,24);/q;+1/p-1