2,3-bis(2-methylheptacosanoyloxy)propyl 2-methylheptacosanoate

Systemtic Name: 2,3-bis(2-methylheptacosanoyloxy)propyl 2-methylheptacosanoate Openeye Name: 2,3-bis(2-methylheptacosanoyloxy)propyl 2-methylheptacosanoate CAS Name: 2-methylheptacosanoic acid 2,3-bis(2-methyl-1-oxoheptacosoxy)propyl ester IUPAC Name: 2,3-bis(2-methylheptacosanoyloxy)propyl 2-methylheptacosanoate Traditional Name: 2-methylheptacosanoic acid 2,3-bis(2-methylheptacosanoyloxy)propyl ester Formula: C87H170O6 MolecularWeight: 1312.2771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC(C)C(=O)OCC(COC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(C)C(=O)OCC(COC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)C(C)CCCCCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C87H170O6/c1-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-64-67-70-73-76-81(4)85(88)91-79-84(93-87(90)83(6)78-75-72-69-66-63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-3)80-92-86(89)82(5)77-74-71-68-65-62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-2/h81-84H,7-80H2,1-6H3