calcium 2-oxidanyloctadecanoate

Systemtic Name: calcium 2-oxidanyloctadecanoate Openeye Name: calcium 2-hydroxyoctadecanoate CAS Name: calcium 2-hydroxyoctadecanoate IUPAC Name: calcium 2-hydroxyoctadecanoate Traditional Name: calcium 2-hydroxystearate Formula: C18H35CaO3+ MolecularWeight: 339.5467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C(=O)[O-])O.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C(=O)[O-])O.[Ca+2]

InChI

InChI=1S/C18H36O3.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21;/h17,19H,2-16H2,1H3,(H,20,21);/q;+2/p-1