[3-tetradecanoyloxy-2,2-bis(tetradecanoyloxymethyl)propyl] cyclotridecanecarboxylate

Systemtic Name: [3-tetradecanoyloxy-2,2-bis(tetradecanoyloxymethyl)propyl] cyclotridecanecarboxylate Openeye Name: [3-tetradecanoyloxy-2,2-bis(tetradecanoyloxymethyl)propyl] cyclotridecanecarboxylate CAS Name: cyclotridecanecarboxylic acid [3-(1-oxotetradecoxy)-2,2-bis(1-oxotetradecoxymethyl)propyl] ester IUPAC Name: [3-tetradecanoyloxy-2,2-bis(tetradecanoyloxymethyl)propyl] cyclotridecanecarboxylate Traditional Name: cyclotridecanecarboxylic acid [3-tetradecanoyloxy-2,2-bis(tetradecanoyloxymethyl)propyl] ester Formula: C61H114O8 MolecularWeight: 975.55306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCC)COC(=O)C1CCCCCCCCCCCC1

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCC)COC(=O)C1CCCCCCCCCCCC1

InChI

InChI=1S/C61H114O8/c1-4-7-10-13-16-19-22-29-34-39-44-49-57(62)66-52-61(53-67-58(63)50-45-40-35-30-23-20-17-14-11-8-5-2,54-68-59(64)51-46-41-36-31-24-21-18-15-12-9-6-3)55-69-60(65)56-47-42-37-32-27-25-26-28-33-38-43-48-56/h56H,4-55H2,1-3H3