methanidylbenzene; 4-methylphenol; zirconium(2+)

Systemtic Name: methanidylbenzene; 4-methylphenol; zirconium(2+) Openeye Name: methanidylbenzene; p-cresol; zirconium(2+) CAS Name: methanidylbenzene; 4-methylphenol; zirconium(2+) IUPAC Name: methanidylbenzene; 4-methylphenol; zirconium(2+) Traditional Name: methanidylbenzene; p-cresol; zirconium(2+) Formula: C28H30O2Zr MolecularWeight: 489.7606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)O.CC1=CC=C(C=C1)O.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr+2]

Isomeric SMILES

CC1=CC=C(C=C1)O.CC1=CC=C(C=C1)O.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr+2]

InChI

InChI=1S/2C7H8O.2C7H7.Zr/c2*1-6-2-4-7(8)5-3-6;2*1-7-5-3-2-4-6-7;/h2*2-5,8H,1H3;2*2-6H,1H2;/q;;2*-1;+2