cyclopentane; 1-phenyl-2-propyl-hex-2-en-1-ol; zirconium(3+)

Systemtic Name: cyclopentane; 1-phenyl-2-propyl-hex-2-en-1-ol; zirconium(3+) Openeye Name: cyclopentane; 1-phenyl-2-propyl-hex-2-en-1-ol; zirconium(3+) CAS Name: cyclopentane; 1-phenyl-2-propyl-2-hexen-1-ol; zirconium(3+) IUPAC Name: cyclopentane; 1-phenyl-2-propylhex-2-en-1-ol; zirconium(3+) Traditional Name: cyclopentane; 1-phenyl-2-propyl-hex-2-en-1-ol; zirconium(3+) Formula: C25H31OZr+2 MolecularWeight: 438.73704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21O.2C5H5.Zr/c1-3-5-10-13(9-4-2)15(16)14-11-7-6-8-12-14;2*1-2-4-5-3-1;/h6-8,11-12,15-16H,3-5,9H2,1-2H3;2*1-5H;/q-1;;;+3