2-chloranyl-1-cyclopentyl-ethanone; 5-cyclopentyl-2-(4-nitrophenyl)-1,3-oxazole; iron(2+)

Systemtic Name: 2-chloranyl-1-cyclopentyl-ethanone; 5-cyclopentyl-2-(4-nitrophenyl)-1,3-oxazole; iron(2+) Openeye Name: ferrous; 2-chloro-1-cyclopentyl-ethanone; 5-cyclopentyl-2-(4-nitrophenyl)oxazole CAS Name: 2-chloro-1-cyclopentylethanone; 5-cyclopentyl-2-(4-nitrophenyl)oxazole; iron(2+) IUPAC Name: 2-chloro-1-cyclopentylethanone; 5-cyclopentyl-2-(4-nitrophenyl)-1,3-oxazole; iron(2+) Traditional Name: ferrous; 2-chloro-1-cyclopentyl-ethanone; 5-cyclopentyl-2-(4-nitrophenyl)oxazole Formula: C21H15ClFeN2O4+2 MolecularWeight: 450.6528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(O2)[C]3[CH][CH][CH][CH]3)[N+](=O)[O-].[CH]1[CH][CH][C]([CH]1)C(=O)CCl.[Fe+2]

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(O2)[C]3[CH][CH][CH][CH]3)[N+](=O)[O-].[CH]1[CH][CH][C]([CH]1)C(=O)CCl.[Fe+2]

InChI

InChI=1S/C14H9N2O3.C7H6ClO.Fe/c17-16(18)12-7-5-11(6-8-12)14-15-9-13(19-14)10-3-1-2-4-10;8-5-7(9)6-3-1-2-4-6;/h1-9H;1-4H,5H2;/q;;+2