cyclopentane; [(1S,2R)-6-iodanyl-2-methanidyl-1-phenyl-hexyl]-phenyl-azanide; zirconium(4+)

Systemtic Name: cyclopentane; [(1S,2R)-6-iodanyl-2-methanidyl-1-phenyl-hexyl]-phenyl-azanide; zirconium(4+) Openeye Name: cyclopentane; [(1S,2R)-6-iodo-2-methanidyl-1-phenyl-hexyl]-phenyl-azanide; zirconium(4+) CAS Name: cyclopentane; [(1S,2R)-6-iodo-2-methanidyl-1-phenylhexyl]-phenylazanide; zirconium(4+) IUPAC Name: cyclopentane; [(1S,2R)-6-iodo-2-methanidyl-1-phenylhexyl]-phenylazanide; zirconium(4+) Traditional Name: cyclopentane; [(1S,2R)-6-iodo-2-methanidyl-1-phenyl-hexyl]-phenyl-azanide; zirconium(4+) Formula: C29H32INZr+2 MolecularWeight: 612.69955

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C(CCCCI)C(C1=CC=CC=C1)[N-]C2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

[CH2-][C@H](CCCCI)[C@@H](C1=CC=CC=C1)[N-]C2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C19H22IN.2C5H5.Zr/c1-16(10-8-9-15-20)19(17-11-4-2-5-12-17)21-18-13-6-3-7-14-18;2*1-2-4-5-3-1;/h2-7,11-14,16,19H,1,8-10,15H2;2*1-5H;/q-2;;;+4/t16-,19+;;;/m1.../s1