2,4-dimethylphenol; 1,2,4-trimethylcyclopenta-1,3-diene; zirconium

Systemtic Name: 2,4-dimethylphenol; 1,2,4-trimethylcyclopenta-1,3-diene; zirconium Openeye Name: 2,4-dimethylphenol; 1,2,4-trimethylcyclopenta-1,3-diene; zirconium CAS Name: 2,4-dimethylphenol; 1,2,4-trimethylcyclopenta-1,3-diene; zirconium IUPAC Name: 2,4-dimethylphenol; 1,2,4-trimethylcyclopenta-1,3-diene; zirconium Traditional Name: 1,2,4-trimethylcyclopenta-1,3-diene; 2,4-xylenol; zirconium Formula: C32H44O2Zr MolecularWeight: 551.91456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C1)C)C.CC1=CC(=C(C1)C)C.CC1=CC(=C(C=C1)O)C.CC1=CC(=C(C=C1)O)C.[Zr]

Isomeric SMILES

CC1=CC(=C(C1)C)C.CC1=CC(=C(C1)C)C.CC1=CC(=C(C=C1)O)C.CC1=CC(=C(C=C1)O)C.[Zr]

InChI

InChI=1S/2C8H10O.2C8H12.Zr/c2*1-6-3-4-8(9)7(2)5-6;2*1-6-4-7(2)8(3)5-6;/h2*3-5,9H,1-2H3;2*4H,5H2,1-3H3;