docosyl docosanoate

Systemtic Name: docosyl docosanoate Openeye Name: docosyl docosanoate CAS Name: docosanoic acid docosyl ester IUPAC Name: docosyl docosanoate Traditional Name: behenic acid behenyl ester Formula: C44H88O2 MolecularWeight: 649.16832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C44H88O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-46-44(45)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-43H2,1-2H3