[1-(dimethylamino)-1-docosanoyloxy-ethyl] docosanoate

Systemtic Name: [1-(dimethylamino)-1-docosanoyloxy-ethyl] docosanoate Openeye Name: [1-(dimethylamino)-1-docosanoyloxy-ethyl] docosanoate CAS Name: docosanoic acid [1-(dimethylamino)-1-(1-oxodocosoxy)ethyl] ester IUPAC Name: [1-(dimethylamino)-1-docosanoyloxyethyl] docosanoate Traditional Name: behenic acid [1-(dimethylamino)-1-docosanoyloxy-ethyl] ester Formula: C48H95NO4 MolecularWeight: 750.2722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)(N(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OC(C)(N(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C48H95NO4/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46(50)52-48(3,49(4)5)53-47(51)45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h6-45H2,1-5H3