bis[(E)-docos-13-enyl] sulfate

Systemtic Name: bis[(E)-docos-13-enyl] sulfate Openeye Name: bis[(E)-docos-13-enyl] sulfate CAS Name: sulfuric acid bis[(E)-docos-13-enyl] ester IUPAC Name: bis[(E)-docos-13-enyl] sulfate Traditional Name: sulfuric acid bis[(E)-docos-13-enyl] ester Formula: C44H86O4S MolecularWeight: 711.21624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCCOS(=O)(=O)OCCCCCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCCOS(=O)(=O)OCCCCCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C44H86O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-47-49(45,46)48-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-44H2,1-2H3/b19-17+,20-18+