sodium [(E)-1-acetyloxyhexadec-1-enyl] sulfate

Systemtic Name: sodium [(E)-1-acetyloxyhexadec-1-enyl] sulfate Openeye Name: sodium [(E)-1-acetoxyhexadec-1-enyl] sulfate CAS Name: sodium [(E)-1-acetyloxyhexadec-1-enyl] sulfate IUPAC Name: sodium [(E)-1-acetyloxyhexadec-1-enyl] sulfate Traditional Name: sodium [(E)-1-acetoxyhexadec-1-enyl] sulfate Formula: C18H33NaO6S MolecularWeight: 400.50579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H34O6S.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(23-17(2)19)24-25(20,21)22;/h16H,3-15H2,1-2H3,(H,20,21,22);/q;+1/p-1/b18-16+;