(4-docosanoyloxy-3-methyl-butyl) cyclohenicosanecarboxylate

Systemtic Name: (4-docosanoyloxy-3-methyl-butyl) cyclohenicosanecarboxylate Openeye Name: (4-docosanoyloxy-3-methyl-butyl) cyclohenicosanecarboxylate CAS Name: cycloheneicosanecarboxylic acid [3-methyl-4-(1-oxodocosoxy)butyl] ester IUPAC Name: (4-docosanoyloxy-3-methylbutyl) cyclohenicosanecarboxylate Traditional Name: cycloheneicosanecarboxylic acid (4-docosanoyloxy-3-methyl-butyl) ester Formula: C49H94O4 MolecularWeight: 747.26826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)CCOC(=O)C1CCCCCCCCCCCCCCCCCCCC1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(C)CCOC(=O)C1CCCCCCCCCCCCCCCCCCCC1

InChI

InChI=1S/C49H94O4/c1-3-4-5-6-7-8-9-10-11-12-13-18-21-24-27-30-33-36-39-42-48(50)53-45-46(2)43-44-52-49(51)47-40-37-34-31-28-25-22-19-16-14-15-17-20-23-26-29-32-35-38-41-47/h46-47H,3-45H2,1-2H3