barium(2+); 12-oxidanyloctadecanoate

Systemtic Name: barium(2+); 12-oxidanyloctadecanoate Openeye Name: barium(2+); 12-hydroxyoctadecanoate CAS Name: barium(2+); 12-hydroxyoctadecanoate IUPAC Name: barium(2+); 12-hydroxyoctadecanoate Traditional Name: barium(2+); 12-hydroxystearate Formula: C36H70BaO6 MolecularWeight: 736.2644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CCCCCCC(CCCCCCCCCCC(=O)[O-])O.[Ba+2]

Isomeric SMILES

CCCCCCC(CCCCCCCCCCC(=O)[O-])O.CCCCCCC(CCCCCCCCCCC(=O)[O-])O.[Ba+2]

InChI

InChI=1S/2C18H36O3.Ba/c2*1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h2*17,19H,2-16H2,1H3,(H,20,21);/q;;+2/p-2