sodium 4-oxidanyloctacosanoate

Systemtic Name: sodium 4-oxidanyloctacosanoate Openeye Name: sodium 4-hydroxyoctacosanoate CAS Name: sodium 4-hydroxyoctacosanoate IUPAC Name: sodium 4-hydroxyoctacosanoate Traditional Name: sodium 4-hydroxymontanate Formula: C28H55NaO3 MolecularWeight: 462.72427

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCC(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C28H56O3.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(29)25-26-28(30)31;/h27,29H,2-26H2,1H3,(H,30,31);/q;+1/p-1