octan-1-one; propane; zirconium(4+)

Systemtic Name: octan-1-one; propane; zirconium(4+) Openeye Name: octan-1-one; propane; zirconium(4+) CAS Name: 1-octanone; propane; zirconium(4+) IUPAC Name: octan-1-one; propane; zirconium(4+) Traditional Name: octan-1-one; propane; zirconium(4+) Formula: C27H52O3Zr MolecularWeight: 515.92398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[C-]=O.CCCCCCC[C-]=O.CCCCCCC[C-]=O.C[CH-]C.[Zr+4]

Isomeric SMILES

CCCCCCC[C-]=O.CCCCCCC[C-]=O.CCCCCCC[C-]=O.C[CH-]C.[Zr+4]

InChI

InChI=1S/3C8H15O.C3H7.Zr/c3*1-2-3-4-5-6-7-8-9;1-3-2;/h3*2-7H2,1H3;3H,1-2H3;/q4*-1;+4