octadecanoyl 2-octadecan-9-yloctadecanoate

Systemtic Name: octadecanoyl 2-octadecan-9-yloctadecanoate Openeye Name: octadecanoyl 2-(1-octyldecyl)octadecanoate CAS Name: 2-octadecan-9-yloctadecanoic acid 1-oxooctadecyl ester IUPAC Name: octadecanoyl 2-octadecan-9-yloctadecanoate Traditional Name: 2-(1-octyldecyl)stearic acid stearoyl ester Formula: C54H106O3 MolecularWeight: 803.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C(CCCCCCCCCCCCCCCC)C(CCCCCCCC)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C(CCCCCCCCCCCCCCCC)C(CCCCCCCC)CCCCCCCCC

InChI

InChI=1S/C54H106O3/c1-5-9-13-17-21-23-25-27-29-31-33-35-38-42-46-50-53(55)57-54(56)52(49-45-41-37-34-32-30-28-26-24-22-18-14-10-6-2)51(47-43-39-20-16-12-8-4)48-44-40-36-19-15-11-7-3/h51-52H,5-50H2,1-4H3