cyclopentane; 1,1-diethoxyprop-1-ene; ethanol; zirconium(3+)

Systemtic Name: cyclopentane; 1,1-diethoxyprop-1-ene; ethanol; zirconium(3+) Openeye Name: cyclopentane; 1,1-diethoxyprop-1-ene; ethanol; zirconium(3+) CAS Name: cyclopentane; 1,1-diethoxy-1-propene; ethanol; zirconium(3+) IUPAC Name: cyclopentane; 1,1-diethoxyprop-1-ene; ethanol; zirconium(3+) Traditional Name: cyclopentane; 1,1-diethoxyprop-1-ene; ethanol; zirconium(3+) Formula: C19H29O3Zr+2 MolecularWeight: 396.65576

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CCOC(=C[CH2-])OCC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

Isomeric SMILES

CCO.CCOC(=C[CH2-])OCC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

InChI

InChI=1S/C7H13O2.2C5H5.C2H6O.Zr/c1-4-7(8-5-2)9-6-3;2*1-2-4-5-3-1;1-2-3;/h4H,1,5-6H2,2-3H3;2*1-5H;3H,2H2,1H3;/q-1;;;;+3