dimethylsilicon; 2-methyl-4-phenyl-1H-inden-1-ide; [(1E,3E)-4-phenylpenta-1,3-dienyl]benzene; zirconium(2+)

Systemtic Name: dimethylsilicon; 2-methyl-4-phenyl-1H-inden-1-ide; [(1E,3E)-4-phenylpenta-1,3-dienyl]benzene; zirconium(2+) Openeye Name: dimethylsilicon; [(1E,3E)-1-methyl-4-phenyl-buta-1,3-dienyl]benzene; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+) CAS Name: dimethylsilicon; 2-methyl-4-phenyl-1H-inden-1-ide; [(1E,3E)-4-phenylpenta-1,3-dienyl]benzene; zirconium(2+) IUPAC Name: dimethylsilicon; 2-methyl-4-phenyl-1H-inden-1-ide; [(1E,3E)-4-phenylpenta-1,3-dienyl]benzene; zirconium(2+) Traditional Name: dimethylsilicon; [(1E,3E)-1-methyl-4-phenyl-buta-1,3-dienyl]benzene; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+) Formula: C51H48SiZr MolecularWeight: 780.23632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC(=CC=CC1=CC=CC=C1)C2=CC=CC=C2.C[Si]C.[Zr+2]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.C/C(=C\C=C\C1=CC=CC=C1)/C2=CC=CC=C2.C[Si]C.[Zr+2]

InChI

InChI=1S/C17H16.2C16H13.C2H6Si.Zr/c1-15(17-13-6-3-7-14-17)9-8-12-16-10-4-2-5-11-16;2*1-12-10-14-8-5-9-15(16(14)11-12)13-6-3-2-4-7-13;1-3-2;/h2-14H,1H3;2*2-11H,1H3;1-2H3;/q;2*-1;;+2/b12-8+,15-9+;;;;