butanoate; octadecanoate; zirconium(2+)

Systemtic Name: butanoate; octadecanoate; zirconium(2+) Openeye Name: butanoate; octadecanoate; zirconium(2+) CAS Name: butanoate; octadecanoate; zirconium(2+) IUPAC Name: butanoate; octadecanoate; zirconium(2+) Traditional Name: butyrate; stearate; zirconium(2+) Formula: C22H42O4Zr MolecularWeight: 461.79048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCC(=O)[O-].[Zr+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CCCC(=O)[O-].[Zr+2]

InChI

InChI=1S/C18H36O2.C4H8O2.Zr/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4(5)6;/h2-17H2,1H3,(H,19,20);2-3H2,1H3,(H,5,6);/q;;+2/p-2