2-ethylhexyl 12-[[18-(2-ethylhexoxy)-18-oxidanylidene-octadecan-7-yl]oxymethoxy]octadecanoate

Systemtic Name: 2-ethylhexyl 12-[[18-(2-ethylhexoxy)-18-oxidanylidene-octadecan-7-yl]oxymethoxy]octadecanoate Openeye Name: 2-ethylhexyl 12-[[12-(2-ethylhexoxy)-1-hexyl-12-oxo-dodecoxy]methoxy]octadecanoate CAS Name: 12-[[18-(2-ethylhexoxy)-18-oxooctadecan-7-yl]oxymethoxy]octadecanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 12-[[18-(2-ethylhexoxy)-18-oxooctadecan-7-yl]oxymethoxy]octadecanoate Traditional Name: 12-[[12-(2-ethylhexoxy)-1-hexyl-12-keto-dodecoxy]methoxy]stearic acid 2-ethylhexyl ester Formula: C53H104O6 MolecularWeight: 837.38926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCC(=O)OCC(CC)CCCC)OCOC(CCCCCC)CCCCCCCCCCC(=O)OCC(CC)CCCC

Isomeric SMILES

CCCCCCC(CCCCCCCCCCC(=O)OCC(CC)CCCC)OCOC(CCCCCC)CCCCCCCCCCC(=O)OCC(CC)CCCC

InChI

InChI=1S/C53H104O6/c1-7-13-17-31-39-50(41-33-27-23-19-21-25-29-35-43-52(54)56-45-48(11-5)37-15-9-3)58-47-59-51(40-32-18-14-8-2)42-34-28-24-20-22-26-30-36-44-53(55)57-46-49(12-6)38-16-10-4/h48-51H,7-47H2,1-6H3