tris(8-ethanoyloctadecan-9-yl) 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: tris(8-ethanoyloctadecan-9-yl) 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: tris[1-(1-acetyloctyl)decyl] 2-hydroxypropane-1,2,3-tricarboxylate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid tris(8-acetyloctadecan-9-yl) ester IUPAC Name: tris(8-acetyloctadecan-9-yl) 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-hydroxypropane-1,2,3-tricarboxylic acid tris[1-(1-acetyloctyl)decyl] ester Formula: C66H122O10 MolecularWeight: 1075.66888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CCCCCCC)C(=O)C)OC(=O)CC(CC(=O)OC(CCCCCCCCC)C(CCCCCCC)C(=O)C)(C(=O)OC(CCCCCCCCC)C(CCCCCCC)C(=O)C)O

Isomeric SMILES

CCCCCCCCCC(C(CCCCCCC)C(=O)C)OC(=O)CC(CC(=O)OC(CCCCCCCCC)C(CCCCCCC)C(=O)C)(C(=O)OC(CCCCCCCCC)C(CCCCCCC)C(=O)C)O

InChI

InChI=1S/C66H122O10/c1-10-16-22-28-31-37-43-49-60(57(54(7)67)46-40-34-25-19-13-4)74-63(70)52-66(73,65(72)76-62(51-45-39-33-30-24-18-12-3)59(56(9)69)48-42-36-27-21-15-6)53-64(71)75-61(50-44-38-32-29-23-17-11-2)58(55(8)68)47-41-35-26-20-14-5/h57-62,73H,10-53H2,1-9H3