cyclopentane; [(2R,3R)-7-iodanyl-3-methanidyl-heptan-2-yl]-phenyl-azanide; zirconium(4+)

Systemtic Name: cyclopentane; [(2R,3R)-7-iodanyl-3-methanidyl-heptan-2-yl]-phenyl-azanide; zirconium(4+) Openeye Name: cyclopentane; [(1R,2R)-6-iodo-2-methanidyl-1-methyl-hexyl]-phenyl-azanide; zirconium(4+) CAS Name: cyclopentane; [(2R,3R)-7-iodo-3-methanidylheptan-2-yl]-phenylazanide; zirconium(4+) IUPAC Name: cyclopentane; [(2R,3R)-7-iodo-3-methanidylheptan-2-yl]-phenylazanide; zirconium(4+) Traditional Name: cyclopentane; [(1R,2R)-6-iodo-2-methanidyl-1-methyl-hexyl]-phenyl-azanide; zirconium(4+) Formula: C24H30INZr+2 MolecularWeight: 550.63017

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20IN.2C5H5.Zr/c1-12(8-6-7-11-15)13(2)16-14-9-4-3-5-10-14;2*1-2-4-5-3-1;/h3-5,9-10,12-13H,1,6-8,11H2,2H3;2*1-5H;/q-2;;;+4/t12-,13-;;;/m1.../s1