4-methyl-2-(5-methyl-2-oxidanyl-phenyl)phenol; zirconium

Systemtic Name: 4-methyl-2-(5-methyl-2-oxidanyl-phenyl)phenol; zirconium Openeye Name: 2-(2-hydroxy-5-methyl-phenyl)-4-methyl-phenol; zirconium CAS Name: 2-(2-hydroxy-5-methylphenyl)-4-methylphenol; zirconium IUPAC Name: 2-(2-hydroxy-5-methylphenyl)-4-methylphenol; zirconium Traditional Name: 2-(2-hydroxy-5-methyl-phenyl)-4-methyl-phenol; zirconium Formula: C28H28O4Zr MolecularWeight: 519.74352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)C)O.CC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)C)O.[Zr]

Isomeric SMILES

CC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)C)O.CC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)C)O.[Zr]

InChI

InChI=1S/2C14H14O2.Zr/c2*1-9-3-5-13(15)11(7-9)12-8-10(2)4-6-14(12)16;/h2*3-8,15-16H,1-2H3;