cyclopentane; (4-cyclopentylthiophen-2-yl)-(3-nitrophenyl)methanone; iron(2+)

Systemtic Name: cyclopentane; (4-cyclopentylthiophen-2-yl)-(3-nitrophenyl)methanone; iron(2+) Openeye Name: ferrous; cyclopentane; (4-cyclopentyl-2-thienyl)-(3-nitrophenyl)methanone CAS Name: cyclopentane; (4-cyclopentyl-2-thiophenyl)-(3-nitrophenyl)methanone; iron(2+) IUPAC Name: cyclopentane; (4-cyclopentylthiophen-2-yl)-(3-nitrophenyl)methanone; iron(2+) Traditional Name: ferrous; cyclopentane; (4-cyclopentyl-2-thienyl)-(3-nitrophenyl)methanone Formula: C21H15FeNO3S+2 MolecularWeight: 417.2587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C2=CC(=CS2)[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-])C(=O)C2=CC(=CS2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C16H10NO3S.C5H5.Fe/c18-16(12-6-3-7-14(8-12)17(19)20)15-9-13(10-21-15)11-4-1-2-5-11;1-2-4-5-3-1;/h1-10H;1-5H;/q;;+2