dodecanoate; 2-methylprop-2-enoic acid; zirconium(3+)

Systemtic Name: dodecanoate; 2-methylprop-2-enoic acid; zirconium(3+) Openeye Name: dodecanoate; 2-methylprop-2-enoic acid; zirconium(3+) CAS Name: dodecanoate; 2-methyl-2-propenoic acid; zirconium(3+) IUPAC Name: dodecanoate; 2-methylprop-2-enoic acid; zirconium(3+) Traditional Name: laurate; methacrylic acid; zirconium(3+) Formula: C40H75O8Zr MolecularWeight: 775.2427

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CC(=C)C(=O)O.[Zr+3]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CC(=C)C(=O)O.[Zr+3]

InChI

InChI=1S/3C12H24O2.C4H6O2.Zr/c3*1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-3(2)4(5)6;/h3*2-11H2,1H3,(H,13,14);1H2,2H3,(H,5,6);/q;;;;+3/p-3