calcium 12-oxidanylideneoctadecanoate

Systemtic Name: calcium 12-oxidanylideneoctadecanoate Openeye Name: calcium 12-oxooctadecanoate CAS Name: calcium 12-oxooctadecanoate IUPAC Name: calcium 12-oxooctadecanoate Traditional Name: calcium 12-ketostearate Formula: C36H66CaO6 MolecularWeight: 634.98364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C18H34O3.Ca/c2*1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;/h2*2-16H2,1H3,(H,20,21);/q;;+2/p-2