[(E)-tetradec-1-enyl] 2-sulfooxyhexanoate

Systemtic Name: [(E)-tetradec-1-enyl] 2-sulfooxyhexanoate Openeye Name: [(E)-tetradec-1-enyl] 2-sulfooxyhexanoate CAS Name: 2-sulfooxyhexanoic acid [(E)-tetradec-1-enyl] ester IUPAC Name: [(E)-tetradec-1-enyl] 2-sulfooxyhexanoate Traditional Name: 2-sulfoxyhexanoic acid [(E)-tetradec-1-enyl] ester Formula: C20H38O6S MolecularWeight: 406.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=COC(=O)C(CCCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCC/C=C/OC(=O)C(CCCC)OS(=O)(=O)O

InChI

InChI=1S/C20H38O6S/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-25-20(21)19(17-6-4-2)26-27(22,23)24/h16,18-19H,3-15,17H2,1-2H3,(H,22,23,24)/b18-16+