(4E)-2-azanyl-6-cyclopentyl-4-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3-carbonitrile; cyclopentane; iron(2+)

Systemtic Name: (4E)-2-azanyl-6-cyclopentyl-4-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3-carbonitrile; cyclopentane; iron(2+) Openeye Name: ferrous; (4E)-2-amino-6-cyclopentyl-4-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3-carbonitrile; cyclopentane CAS Name: (4E)-2-amino-6-cyclopentyl-4-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridine-3-carbonitrile; cyclopentane; iron(2+) IUPAC Name: (4E)-2-amino-6-cyclopentyl-4-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3-carbonitrile; cyclopentane; iron(2+) Traditional Name: ferrous; (4E)-2-amino-6-cyclopentyl-4-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)-1H-pyridine-3-carbonitrile; cyclopentane Formula: C22H16FeN4O3+2 MolecularWeight: 440.23244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=C2C=C(NC(=C2C#N)N)[C]3[CH][CH][CH][CH]3)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C\1=CC(=O)C(=C/C1=C/2\C=C(NC(=C2C#N)N)[C]3[CH][CH][CH][CH]3)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C17H11N4O3.C5H5.Fe/c18-9-13-12(11-5-6-16(22)15(7-11)21(23)24)8-14(20-17(13)19)10-3-1-2-4-10;1-2-4-5-3-1;/h1-8,20H,19H2;1-5H;/q;;+2