[7-[4-(8-icosanoyloxy-2,6-dimethyl-octan-2-yl)-2-methoxy-5-oxidanyl-phenyl]-3,7-dimethyl-octyl] icosanoate

Systemtic Name: [7-[4-(8-icosanoyloxy-2,6-dimethyl-octan-2-yl)-2-methoxy-5-oxidanyl-phenyl]-3,7-dimethyl-octyl] icosanoate Openeye Name: [7-[5-hydroxy-4-(7-icosanoyloxy-1,1,5-trimethyl-heptyl)-2-methoxy-phenyl]-3,7-dimethyl-octyl] icosanoate CAS Name: eicosanoic acid [7-[4-[2,6-dimethyl-8-(1-oxoeicosoxy)octan-2-yl]-5-hydroxy-2-methoxyphenyl]-3,7-dimethyloctyl] ester IUPAC Name: [7-[5-hydroxy-4-(8-icosanoyloxy-2,6-dimethyloctan-2-yl)-2-methoxyphenyl]-3,7-dimethyloctyl] icosanoate Traditional Name: arachidic acid [7-[4-(7-eicosanoyloxy-1,1,5-trimethyl-heptyl)-5-hydroxy-2-methoxy-phenyl]-3,7-dimethyl-octyl] ester Formula: C67H124O6 MolecularWeight: 1025.69786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OCCC(C)CCCC(C)(C)C1=CC(=C(C=C1OC)C(C)(C)CCCC(C)CCOC(=O)CCCCCCCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OCCC(C)CCCC(C)(C)C1=CC(=C(C=C1OC)C(C)(C)CCCC(C)CCOC(=O)CCCCCCCCCCCCCCCCCCC)O

InChI

InChI=1S/C67H124O6/c1-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-48-64(69)72-54-50-58(3)46-44-52-66(5,6)60-57-63(71-9)61(56-62(60)68)67(7,8)53-45-47-59(4)51-55-73-65(70)49-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-2/h56-59,68H,10-55H2,1-9H3