(1-dodecanoyloxy-3-hexadecanoyloxy-propan-2-yl) octadecanoate

Systemtic Name: (1-dodecanoyloxy-3-hexadecanoyloxy-propan-2-yl) octadecanoate Openeye Name: [1-(dodecanoyloxymethyl)-2-hexadecanoyloxy-ethyl] octadecanoate CAS Name: octadecanoic acid [1-(1-oxododecoxy)-3-(1-oxohexadecoxy)propan-2-yl] ester IUPAC Name: (1-dodecanoyloxy-3-hexadecanoyloxypropan-2-yl) octadecanoate Traditional Name: stearic acid [1-(hexadecanoyloxymethyl)-2-lauroyloxy-ethyl] ester Formula: C49H94O6 MolecularWeight: 779.26706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C49H94O6/c1-4-7-10-13-16-19-21-23-24-26-28-31-34-37-40-43-49(52)55-46(44-53-47(50)41-38-35-32-29-18-15-12-9-6-3)45-54-48(51)42-39-36-33-30-27-25-22-20-17-14-11-8-5-2/h46H,4-45H2,1-3H3