hexadecanoyloxymethyl (E)-2-ethyl-2-octadecanoyloxy-octadec-9-enoate

Systemtic Name: hexadecanoyloxymethyl (E)-2-ethyl-2-octadecanoyloxy-octadec-9-enoate Openeye Name: hexadecanoyloxymethyl (E)-2-ethyl-2-octadecanoyloxy-octadec-9-enoate CAS Name: (E)-2-ethyl-2-(1-oxooctadecoxy)-9-octadecenoic acid 1-oxohexadecoxymethyl ester IUPAC Name: hexadecanoyloxymethyl (E)-2-ethyl-2-octadecanoyloxyoctadec-9-enoate Traditional Name: (E)-2-ethyl-2-stearoyloxy-octadec-9-enoic acid hexadecanoyloxymethyl ester Formula: C55H104O6 MolecularWeight: 861.41066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CC)(CCCCCCC=CCCCCCCCC)C(=O)OCOC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CC)(CCCCCC/C=C/CCCCCCCC)C(=O)OCOC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C55H104O6/c1-5-9-12-15-18-21-24-27-29-31-34-37-40-43-46-49-53(57)61-55(8-4,50-47-44-41-38-35-32-28-25-22-19-16-13-10-6-2)54(58)60-51-59-52(56)48-45-42-39-36-33-30-26-23-20-17-14-11-7-3/h28,32H,5-27,29-31,33-51H2,1-4H3/b32-28+