methylbenzene; oxygen(2-); zirconium(4+)

Systemtic Name: methylbenzene; oxygen(2-); zirconium(4+) Openeye Name: oxygen(2-); toluene; zirconium(4+) CAS Name: oxygen(2-); toluene; zirconium(4+) IUPAC Name: oxygen(2-); toluene; zirconium(4+) Traditional Name: oxygen(2-); toluene; zirconium(4+) Formula: C7H8O2Zr MolecularWeight: 215.36122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.[O-2].[O-2].[Zr+4]

Isomeric SMILES

CC1=CC=CC=C1.[O-2].[O-2].[Zr+4]

InChI

InChI=1S/C7H8.2O.Zr/c1-7-5-3-2-4-6-7;;;/h2-6H,1H3;;;/q;2*-2;+4