6-(2-methylhenicosanoyloxy)hexyl cyclohenicosanecarboxylate

Systemtic Name: 6-(2-methylhenicosanoyloxy)hexyl cyclohenicosanecarboxylate Openeye Name: 6-(2-methylhenicosanoyloxy)hexyl cyclohenicosanecarboxylate CAS Name: cycloheneicosanecarboxylic acid 6-(2-methyl-1-oxoheneicosoxy)hexyl ester IUPAC Name: 6-(2-methylhenicosanoyloxy)hexyl cyclohenicosanecarboxylate Traditional Name: cycloheneicosanecarboxylic acid 6-(2-methylheneicosanoyloxy)hexyl ester Formula: C50H96O4 MolecularWeight: 761.29484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(C)C(=O)OCCCCCCOC(=O)C1CCCCCCCCCCCCCCCCCCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(C)C(=O)OCCCCCCOC(=O)C1CCCCCCCCCCCCCCCCCCCC1

InChI

InChI=1S/C50H96O4/c1-3-4-5-6-7-8-9-10-11-14-17-20-23-26-29-32-37-42-47(2)49(51)53-45-40-35-36-41-46-54-50(52)48-43-38-33-30-27-24-21-18-15-12-13-16-19-22-25-28-31-34-39-44-48/h47-48H,3-46H2,1-2H3