[4-[2-(tert-butylamino)ethanoyl]-2-docosanoyloxy-phenyl] docosanoate

Systemtic Name: [4-[2-(tert-butylamino)ethanoyl]-2-docosanoyloxy-phenyl] docosanoate Openeye Name: [4-[2-(tert-butylamino)acetyl]-2-docosanoyloxy-phenyl] docosanoate CAS Name: docosanoic acid [4-[2-(tert-butylamino)-1-oxoethyl]-2-(1-oxodocosoxy)phenyl] ester IUPAC Name: [4-[2-(tert-butylamino)acetyl]-2-docosanoyloxyphenyl] docosanoate Traditional Name: behenic acid [4-[2-(tert-butylamino)acetyl]-2-docosanoyloxy-phenyl] ester Formula: C56H101NO5 MolecularWeight: 868.40484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)CNC(C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C56H101NO5/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-54(59)61-52-47-46-50(51(58)49-57-56(3,4)5)48-53(52)62-55(60)45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h46-48,57H,6-45,49H2,1-5H3