3-acetyloxycarbonyl-4-decoxycarbonyl-3-octoxy-4-octyl-dodecanoic acid

Systemtic Name: 3-acetyloxycarbonyl-4-decoxycarbonyl-3-octoxy-4-octyl-dodecanoic acid Openeye Name: 3-acetoxycarbonyl-4-decoxycarbonyl-3-octoxy-4-octyl-dodecanoic acid CAS Name: 3-[acetyloxy(oxo)methyl]-4-[decoxy(oxo)methyl]-3-octoxy-4-octyldodecanoic acid IUPAC Name: 3-acetyloxycarbonyl-4-decoxycarbonyl-3-octoxy-4-octyldodecanoic acid Traditional Name: 3-acetoxycarbonyl-4-decoxycarbonyl-3-octoxy-4-octyl-lauric acid Formula: C42H78O8 MolecularWeight: 711.06392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C(CCCCCCCC)(CCCCCCCC)C(CC(=O)O)(C(=O)OC(=O)C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC(=O)C(CCCCCCCC)(CCCCCCCC)C(CC(=O)O)(C(=O)OC(=O)C)OCCCCCCCC

InChI

InChI=1S/C42H78O8/c1-6-10-14-18-22-23-26-30-34-48-39(46)41(32-28-24-19-15-11-7-2,33-29-25-20-16-12-8-3)42(36-38(44)45,40(47)50-37(5)43)49-35-31-27-21-17-13-9-4/h6-36H2,1-5H3,(H,44,45)