docosanoate; iron(2+)

Systemtic Name: docosanoate; iron(2+) Openeye Name: ferrous docosanoate CAS Name: docosanoate; iron(2+) IUPAC Name: docosanoate; iron(2+) Traditional Name: ferrous behenate Formula: C66H129FeO6- MolecularWeight: 1074.57186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCCCCCC(=O)[O-].[Fe+2]

InChI

InChI=1S/3C22H44O2.Fe/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;/h3*2-21H2,1H3,(H,23,24);/q;;;+2/p-3