cyclopentane; 2,4-dimethylpentan-3-ol; [(E)-prop-1-enyl]benzene; zirconium(3+)

Systemtic Name: cyclopentane; 2,4-dimethylpentan-3-ol; [(E)-prop-1-enyl]benzene; zirconium(3+) Openeye Name: cyclopentane; 2,4-dimethylpentan-3-ol; [(E)-prop-1-enyl]benzene; zirconium(3+) CAS Name: cyclopentane; 2,4-dimethyl-3-pentanol; [(E)-prop-1-enyl]benzene; zirconium(3+) IUPAC Name: cyclopentane; 2,4-dimethylpentan-3-ol; [(E)-prop-1-enyl]benzene; zirconium(3+) Traditional Name: cyclopentane; 2,4-dimethylpentan-3-ol; [(E)-prop-1-enyl]benzene; zirconium(3+) Formula: C26H35OZr+2 MolecularWeight: 454.7795

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)O.[CH2-]C=CC1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

Isomeric SMILES

CC(C)C(C(C)C)O.[CH2-]/C=C/C1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

InChI

InChI=1S/C9H9.C7H16O.2C5H5.Zr/c1-2-6-9-7-4-3-5-8-9;1-5(2)7(8)6(3)4;2*1-2-4-5-3-1;/h2-8H,1H2;5-8H,1-4H3;2*1-5H;/q-1;;;;+3/b6-2+;;;;