sodium (3-ethanoyl-2-oxidanylidene-hexadecan-3-yl) sulfate

Systemtic Name: sodium (3-ethanoyl-2-oxidanylidene-hexadecan-3-yl) sulfate Openeye Name: sodium 1,1-diacetyltetradecyl sulfate CAS Name: sodium (3-acetyl-2-oxohexadecan-3-yl) sulfate IUPAC Name: sodium (3-acetyl-2-oxohexadecan-3-yl) sulfate Traditional Name: sodium 1,1-diacetyltetradecyl sulfate Formula: C18H33NaO6S MolecularWeight: 400.50579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O6S.Na/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(16(2)19,17(3)20)24-25(21,22)23;/h4-15H2,1-3H3,(H,21,22,23);/q;+1/p-1