2-(2-ethylhexyl)-18-oxidanyl-octadecanoate

Systemtic Name: 2-(2-ethylhexyl)-18-oxidanyl-octadecanoate Openeye Name: 2-(2-ethylhexyl)-18-hydroxy-octadecanoate CAS Name: 2-(2-ethylhexyl)-18-hydroxyoctadecanoate IUPAC Name: 2-(2-ethylhexyl)-18-hydroxyoctadecanoate Traditional Name: 2-(2-ethylhexyl)-18-hydroxy-stearate Formula: C26H51O3- MolecularWeight: 411.68134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CCCCCCCCCCCCCCCCO)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)CC(CCCCCCCCCCCCCCCCO)C(=O)[O-]

InChI

InChI=1S/C26H52O3/c1-3-5-20-24(4-2)23-25(26(28)29)21-18-16-14-12-10-8-6-7-9-11-13-15-17-19-22-27/h24-25,27H,3-23H2,1-2H3,(H,28,29)/p-1