cyclopentane; [(4R,5R)-5-methanidylnonan-4-yl]-phenyl-azanide; zirconium(4+)

Systemtic Name: cyclopentane; [(4R,5R)-5-methanidylnonan-4-yl]-phenyl-azanide; zirconium(4+) Openeye Name: cyclopentane; [(1R,2R)-2-methanidyl-1-propyl-hexyl]-phenyl-azanide; zirconium(4+) CAS Name: cyclopentane; [(4R,5R)-5-methanidylnonan-4-yl]-phenylazanide; zirconium(4+) IUPAC Name: cyclopentane; [(4R,5R)-5-methanidylnonan-4-yl]-phenylazanide; zirconium(4+) Traditional Name: cyclopentane; [(1R,2R)-2-methanidyl-1-propyl-hexyl]-phenyl-azanide; zirconium(4+) Formula: C26H35NZr+2 MolecularWeight: 452.7868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC([CH2-])C(CCC)[N-]C1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

CCCC[C@@H]([CH2-])[C@@H](CCC)[N-]C1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C16H25N.2C5H5.Zr/c1-4-6-11-14(3)16(10-5-2)17-15-12-8-7-9-13-15;2*1-2-4-5-3-1;/h7-9,12-14,16H,3-6,10-11H2,1-2H3;2*1-5H;/q-2;;;+4/t14-,16-;;;/m1.../s1