cyclopentane; 3-cyclopentyl-5-(4-fluorophenyl)-1-(phenylmethyl)pyrazole; iron(2+)

Systemtic Name: cyclopentane; 3-cyclopentyl-5-(4-fluorophenyl)-1-(phenylmethyl)pyrazole; iron(2+) Openeye Name: ferrous; 1-benzyl-3-cyclopentyl-5-(4-fluorophenyl)pyrazole; cyclopentane CAS Name: cyclopentane; 3-cyclopentyl-5-(4-fluorophenyl)-1-(phenylmethyl)pyrazole; iron(2+) IUPAC Name: 1-benzyl-3-cyclopentyl-5-(4-fluorophenyl)pyrazole; cyclopentane; iron(2+) Traditional Name: ferrous; 1-benzyl-3-cyclopentyl-5-(4-fluorophenyl)pyrazole; cyclopentane Formula: C26H21FFeN2+2 MolecularWeight: 436.301743

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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=C(C=C4)F.[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=C(C=C4)F.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C21H16FN2.C5H5.Fe/c22-19-12-10-18(11-13-19)21-14-20(17-8-4-5-9-17)23-24(21)15-16-6-2-1-3-7-16;1-2-4-5-3-1;/h1-14H,15H2;1-5H;/q;;+2