octadecyl 3-octyltridecanoate

Systemtic Name: octadecyl 3-octyltridecanoate Openeye Name: octadecyl 3-octyltridecanoate CAS Name: 3-octyltridecanoic acid octadecyl ester IUPAC Name: octadecyl 3-octyltridecanoate Traditional Name: 3-octyltridecanoic acid stearyl ester Formula: C39H78O2 MolecularWeight: 579.03542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CC(CCCCCCCC)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC(CCCCCCCC)CCCCCCCCCC

InChI

InChI=1S/C39H78O2/c1-4-7-10-13-16-18-19-20-21-22-23-24-25-27-30-33-36-41-39(40)37-38(34-31-28-15-12-9-6-3)35-32-29-26-17-14-11-8-5-2/h38H,4-37H2,1-3H3