2-octyl-2-(1-oxidanidyl-1-oxidanylidene-octadecan-2-yl)oxy-octadecanoate

Systemtic Name: 2-octyl-2-(1-oxidanidyl-1-oxidanylidene-octadecan-2-yl)oxy-octadecanoate Openeye Name: 2-(1-carboxylatoheptadecoxy)-2-octyl-octadecanoate CAS Name: 2-octyl-2-(1-oxido-1-oxooctadecan-2-yl)oxyoctadecanoate IUPAC Name: 2-octyl-2-(1-oxido-1-oxooctadecan-2-yl)oxyoctadecanoate Traditional Name: 2-(1-carboxylatoheptadecoxy)-2-octyl-stearate Formula: C44H84O5-2 MolecularWeight: 693.13476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)[O-])OC(CCCCCCCC)(CCCCCCCCCCCCCCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)[O-])OC(CCCCCCCC)(CCCCCCCCCCCCCCCC)C(=O)[O-]

InChI

InChI=1S/C44H86O5/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-35-38-41(42(45)46)49-44(43(47)48,39-36-33-15-12-9-6-3)40-37-34-31-29-27-25-23-21-19-17-14-11-8-5-2/h41H,4-40H2,1-3H3,(H,45,46)(H,47,48)/p-2