(2S)-2-cyclopentyl-2-oxidanyl-ethanenitrile; iron(2+)

Systemtic Name: (2S)-2-cyclopentyl-2-oxidanyl-ethanenitrile; iron(2+) Openeye Name: ferrous (2S)-2-cyclopentyl-2-hydroxy-acetonitrile CAS Name: (2S)-2-cyclopentyl-2-hydroxyacetonitrile; iron(2+) IUPAC Name: (2S)-2-cyclopentyl-2-hydroxyacetonitrile; iron(2+) Traditional Name: ferrous (2S)-2-cyclopentyl-2-hydroxy-acetonitrile Formula: C14H12FeN2O2+2 MolecularWeight: 296.10228

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Descriptors Computed from Structure

Canonical SMILES:

[CH]1[CH][CH][C]([CH]1)C(C#N)O.[CH]1[CH][CH][C]([CH]1)C(C#N)O.[Fe+2]

Isomeric SMILES

[CH]1[CH][CH][C]([CH]1)[C@@H](C#N)O.[CH]1[CH][CH][C]([CH]1)[C@@H](C#N)O.[Fe+2]

InChI

InChI=1S/2C7H6NO.Fe/c2*8-5-7(9)6-3-1-2-4-6;/h2*1-4,7,9H;/q;;+2/t2*7-;/m11./s1