dodecyl 2,2,3,3,4,4-hexadodecyl-5-undecyl-heptadecanoate

Systemtic Name: dodecyl 2,2,3,3,4,4-hexadodecyl-5-undecyl-heptadecanoate Openeye Name: dodecyl 2,2,3,3,4,4-hexadodecyl-5-undecyl-heptadecanoate CAS Name: 2,2,3,3,4,4-hexadodecyl-5-undecylheptadecanoic acid dodecyl ester IUPAC Name: dodecyl 2,2,3,3,4,4-hexadodecyl-5-undecylheptadecanoate Traditional Name: 2,2,3,3,4,4-hexalauryl-5-undecyl-heptadecanoic acid lauryl ester Formula: C112H224O2 MolecularWeight: 1602.97576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(CCCCCCCCCCCC)(CCCCCCCCCCCC)C(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C112H224O2/c1-10-19-28-37-46-55-64-73-82-91-100-108(99-90-81-72-63-54-45-36-27-18-9)110(101-92-83-74-65-56-47-38-29-20-11-2,102-93-84-75-66-57-48-39-30-21-12-3)112(105-96-87-78-69-60-51-42-33-24-15-6,106-97-88-79-70-61-52-43-34-25-16-7)111(103-94-85-76-67-58-49-40-31-22-13-4,104-95-86-77-68-59-50-41-32-23-14-5)109(113)114-107-98-89-80-71-62-53-44-35-26-17-8/h108H,10-107H2,1-9H3