[3-(9-oxidanylidenenonanoyloxy)-2,2-bis(9-oxidanylidenenonanoyloxymethyl)propyl] 9-oxidanylidenenonanoate

Systemtic Name: [3-(9-oxidanylidenenonanoyloxy)-2,2-bis(9-oxidanylidenenonanoyloxymethyl)propyl] 9-oxidanylidenenonanoate Openeye Name: [3-(9-oxononanoyloxy)-2,2-bis(9-oxononanoyloxymethyl)propyl] 9-oxononanoate CAS Name: 9-oxononanoic acid [3-(1,9-dioxononoxy)-2,2-bis(1,9-dioxononoxymethyl)propyl] ester IUPAC Name: [3-(9-oxononanoyloxy)-2,2-bis(9-oxononanoyloxymethyl)propyl] 9-oxononanoate Traditional Name: 9-ketopelargonic acid [3-(9-ketononanoyloxy)-2,2-bis(9-ketononanoyloxymethyl)propyl] ester Formula: C41H68O12 MolecularWeight: 752.97142

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC=O)CCCC(=O)OCC(COC(=O)CCCCCCCC=O)(COC(=O)CCCCCCCC=O)COC(=O)CCCCCCCC=O

Isomeric SMILES

C(CCCC=O)CCCC(=O)OCC(COC(=O)CCCCCCCC=O)(COC(=O)CCCCCCCC=O)COC(=O)CCCCCCCC=O

InChI

InChI=1S/C41H68O12/c42-29-21-13-5-1-9-17-25-37(46)50-33-41(34-51-38(47)26-18-10-2-6-14-22-30-43,35-52-39(48)27-19-11-3-7-15-23-31-44)36-53-40(49)28-20-12-4-8-16-24-32-45/h29-32H,1-28,33-36H2