[2-(hydroxymethyl)-3-(14-methylpentadecanoyloxy)-2-(14-methylpentadecanoyloxymethyl)propyl] 14-methylpentadecanoate

Systemtic Name: [2-(hydroxymethyl)-3-(14-methylpentadecanoyloxy)-2-(14-methylpentadecanoyloxymethyl)propyl] 14-methylpentadecanoate Openeye Name: [2-(hydroxymethyl)-3-(14-methylpentadecanoyloxy)-2-(14-methylpentadecanoyloxymethyl)propyl] 14-methylpentadecanoate CAS Name: 14-methylpentadecanoic acid [2-(hydroxymethyl)-3-(14-methyl-1-oxopentadecoxy)-2-[(14-methyl-1-oxopentadecoxy)methyl]propyl] ester IUPAC Name: [2-(hydroxymethyl)-3-(14-methylpentadecanoyloxy)-2-(14-methylpentadecanoyloxymethyl)propyl] 14-methylpentadecanoate Traditional Name: 14-methylpentadecanoic acid [2-methylol-3-(14-methylpentadecanoyloxy)-2-(14-methylpentadecanoyloxymethyl)propyl] ester Formula: C53H102O7 MolecularWeight: 851.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCCCCCCC(=O)OCC(CO)(COC(=O)CCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCC(C)C

InChI

InChI=1S/C53H102O7/c1-47(2)37-31-25-19-13-7-10-16-22-28-34-40-50(55)58-44-53(43-54,45-59-51(56)41-35-29-23-17-11-8-14-20-26-32-38-48(3)4)46-60-52(57)42-36-30-24-18-12-9-15-21-27-33-39-49(5)6/h47-49,54H,7-46H2,1-6H3