cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidyl-cyclohexene; zirconium(4+)

Systemtic Name: cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidyl-cyclohexene; zirconium(4+) Openeye Name: cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidyl-cyclohexene; zirconium(4+) CAS Name: cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidylcyclohexene; zirconium(4+) IUPAC Name: cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidylcyclohexene; zirconium(4+) Traditional Name: cyclopentane; 1,2-dibutyl-4-ethyl-5-methanidyl-cyclohexene; zirconium(4+) Formula: C27H40Zr+2 MolecularWeight: 455.8305

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(CC(C(C1)[CH2-])[CH-]C)CCCC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

CCCCC1=C(CC(C(C1)[CH2-])[CH-]C)CCCC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C17H30.2C5H5.Zr/c1-5-8-10-16-12-14(4)15(7-3)13-17(16)11-9-6-2;2*1-2-4-5-3-1;/h7,14-15H,4-6,8-13H2,1-3H3;2*1-5H;/q-2;;;+4