butane; cyclopentane; N,N-dimethylpyridin-4-amine; zirconium(2+)

Systemtic Name: butane; cyclopentane; N,N-dimethylpyridin-4-amine; zirconium(2+) Openeye Name: butane; cyclopentane; N,N-dimethylpyridin-4-amine; zirconium(2+) CAS Name: butane; cyclopentane; N,N-dimethyl-4-pyridinamine; zirconium(2+) IUPAC Name: butane; cyclopentane; N,N-dimethylpyridin-4-amine; zirconium(2+) Traditional Name: butane; cyclopentane; dimethyl(4-pyridyl)amine; zirconium(2+) Formula: C21H28N2Zr+2 MolecularWeight: 399.68442

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Descriptors Computed from Structure

Canonical SMILES:

CC[CH][CH2].CN(C)C1=CC=NC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+2]

Isomeric SMILES

CC[CH][CH2].CN(C)C1=CC=NC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+2]

InChI

InChI=1S/C7H10N2.2C5H5.C4H8.Zr/c1-9(2)7-3-5-8-6-4-7;2*1-2-4-5-3-1;1-3-4-2;/h3-6H,1-2H3;2*1-5H;3H,1,4H2,2H3;/q;;;;+2