cyclopentane; 3-cyclopentyl-5-phenyl-1-(phenylmethyl)pyrazole; iron(2+)

Systemtic Name: cyclopentane; 3-cyclopentyl-5-phenyl-1-(phenylmethyl)pyrazole; iron(2+) Openeye Name: ferrous; 1-benzyl-3-cyclopentyl-5-phenyl-pyrazole; cyclopentane CAS Name: cyclopentane; 3-cyclopentyl-5-phenyl-1-(phenylmethyl)pyrazole; iron(2+) IUPAC Name: 1-benzyl-3-cyclopentyl-5-phenylpyrazole; cyclopentane; iron(2+) Traditional Name: ferrous; 1-benzyl-3-cyclopentyl-5-phenyl-pyrazole; cyclopentane Formula: C26H22FeN2+2 MolecularWeight: 418.31128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC(=N2)[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC(=N2)[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C21H17N2.C5H5.Fe/c1-3-9-17(10-4-1)16-23-21(19-13-5-2-6-14-19)15-20(22-23)18-11-7-8-12-18;1-2-4-5-3-1;/h1-15H,16H2;1-5H;/q;;+2