[(E)-hexadec-1-enyl] 2-sulfooxypropanoate

Systemtic Name: [(E)-hexadec-1-enyl] 2-sulfooxypropanoate Openeye Name: [(E)-hexadec-1-enyl] 2-sulfooxypropanoate CAS Name: 2-sulfooxypropanoic acid [(E)-hexadec-1-enyl] ester IUPAC Name: [(E)-hexadec-1-enyl] 2-sulfooxypropanoate Traditional Name: 2-sulfoxypropionic acid [(E)-hexadec-1-enyl] ester Formula: C19H36O6S MolecularWeight: 392.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=COC(=O)C(C)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/OC(=O)C(C)OS(=O)(=O)O

InChI

InChI=1S/C19H36O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-19(20)18(2)25-26(21,22)23/h16-18H,3-15H2,1-2H3,(H,21,22,23)/b17-16+