decanoate; zirconium(2+)

Systemtic Name: decanoate; zirconium(2+) Openeye Name: decanoate; zirconium(2+) CAS Name: decanoate; zirconium(2+) IUPAC Name: decanoate; zirconium(2+) Traditional Name: caprate; zirconium(2+) Formula: C60H114O12Zr3 MolecularWeight: 1301.21196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Zr+2].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].CCCCCCCCCC(=O)[O-].[Zr+2].[Zr+2].[Zr+2]

InChI

InChI=1S/6C10H20O2.3Zr/c6*1-2-3-4-5-6-7-8-9-10(11)12;;;/h6*2-9H2,1H3,(H,11,12);;;/q;;;;;;3*+2/p-6