ethyl [(E)-3-ethyl-2-oxidanyl-nonadec-4-en-3-yl] sulfate

Systemtic Name: ethyl [(E)-3-ethyl-2-oxidanyl-nonadec-4-en-3-yl] sulfate Openeye Name: ethyl [(E)-1-ethyl-1-(1-hydroxyethyl)heptadec-2-enyl] sulfate CAS Name: sulfuric acid ethyl [(E)-3-ethyl-2-hydroxynonadec-4-en-3-yl] ester IUPAC Name: ethyl [(E)-3-ethyl-2-hydroxynonadec-4-en-3-yl] sulfate Traditional Name: sulfuric acid ethyl [(E)-1-ethyl-1-(1-hydroxyethyl)heptadec-2-enyl] ester Formula: C23H46O5S MolecularWeight: 434.67334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CC(CC)(C(C)O)OS(=O)(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/C(CC)(C(C)O)OS(=O)(=O)OCC

InChI

InChI=1S/C23H46O5S/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(6-2,22(4)24)28-29(25,26)27-7-3/h20-22,24H,5-19H2,1-4H3/b21-20+