icosan-9-yl 3-octyltridecanoate

Systemtic Name: icosan-9-yl 3-octyltridecanoate Openeye Name: 1-octyldodecyl 3-octyltridecanoate CAS Name: 3-octyltridecanoic acid eicosan-9-yl ester IUPAC Name: icosan-9-yl 3-octyltridecanoate Traditional Name: 3-octyltridecanoic acid 1-octyldodecyl ester Formula: C41H82O2 MolecularWeight: 607.08858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCCCCC)OC(=O)CC(CCCCCCCC)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(CCCCCCCC)OC(=O)CC(CCCCCCCC)CCCCCCCCCC

InChI

InChI=1S/C41H82O2/c1-5-9-13-17-21-23-25-29-33-37-40(36-32-28-20-16-12-8-4)43-41(42)38-39(34-30-26-19-15-11-7-3)35-31-27-24-22-18-14-10-6-2/h39-40H,5-38H2,1-4H3