5,6-dimethyl-2-(4-methylphenyl)-1H-inden-1-ide; zirconium(2+)

Systemtic Name: 5,6-dimethyl-2-(4-methylphenyl)-1H-inden-1-ide; zirconium(2+) Openeye Name: 5,6-dimethyl-2-(p-tolyl)-1H-inden-1-ide; zirconium(2+) CAS Name: 5,6-dimethyl-2-(4-methylphenyl)-1H-inden-1-ide; zirconium(2+) IUPAC Name: 5,6-dimethyl-2-(4-methylphenyl)-1H-inden-1-ide; zirconium(2+) Traditional Name: 5,6-dimethyl-2-(p-tolyl)-1H-inden-1-ide; zirconium(2+) Formula: C36H34Zr MolecularWeight: 557.87916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3[CH-]2)C)C.CC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3[CH-]2)C)C.[Zr+2]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3[CH-]2)C)C.CC1=CC=C(C=C1)C2=CC3=CC(=C(C=C3[CH-]2)C)C.[Zr+2]

InChI

InChI=1S/2C18H17.Zr/c2*1-12-4-6-15(7-5-12)18-10-16-8-13(2)14(3)9-17(16)11-18;/h2*4-11H,1-3H3;/q2*-1;+2