cyclopentane; 4-(5-cyclopentylpyrazol-1-yl)benzoic acid; iron(2+)

Systemtic Name: cyclopentane; 4-(5-cyclopentylpyrazol-1-yl)benzoic acid; iron(2+) Openeye Name: ferrous; cyclopentane; 4-(5-cyclopentylpyrazol-1-yl)benzoic acid CAS Name: cyclopentane; 4-(5-cyclopentyl-1-pyrazolyl)benzoic acid; iron(2+) IUPAC Name: cyclopentane; 4-(5-cyclopentylpyrazol-1-yl)benzoic acid; iron(2+) Traditional Name: ferrous; cyclopentane; 4-(5-cyclopentylpyrazol-1-yl)benzoic acid Formula: C20H16FeN2O2+2 MolecularWeight: 372.19824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N2C(=CC=N2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N2C(=CC=N2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C15H11N2O2.C5H5.Fe/c18-15(19)12-5-7-13(8-6-12)17-14(9-10-16-17)11-3-1-2-4-11;1-2-4-5-3-1;/h1-10H,(H,18,19);1-5H;/q;;+2