cyclopentane; 4-cyclopentyl-6-(3-nitrophenyl)pyrimidin-2-amine; iron(2+)

Systemtic Name: cyclopentane; 4-cyclopentyl-6-(3-nitrophenyl)pyrimidin-2-amine; iron(2+) Openeye Name: ferrous; cyclopentane; 4-cyclopentyl-6-(3-nitrophenyl)pyrimidin-2-amine CAS Name: cyclopentane; 4-cyclopentyl-6-(3-nitrophenyl)-2-pyrimidinamine; iron(2+) IUPAC Name: cyclopentane; 4-cyclopentyl-6-(3-nitrophenyl)pyrimidin-2-amine; iron(2+) Traditional Name: ferrous; cyclopentane; [4-cyclopentyl-6-(3-nitrophenyl)pyrimidin-2-yl]amine Formula: C20H16FeN4O2+2 MolecularWeight: 400.21164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=NC(=N2)N)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=NC(=N2)N)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C15H11N4O2.C5H5.Fe/c16-15-17-13(10-4-1-2-5-10)9-14(18-15)11-6-3-7-12(8-11)19(20)21;1-2-4-5-3-1;/h1-9H,(H2,16,17,18);1-5H;/q;;+2