cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iron(2+); iodide

Systemtic Name: cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iron(2+); iodide Openeye Name: ferrous; cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iodide CAS Name: cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iron(2+); iodide IUPAC Name: cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iron(2+); iodide Traditional Name: ferrous; cyclopentane; 1-(cyclopentylmethyl)-3-methyl-2-[(E)-prop-1-enyl]benzimidazol-3-ium; iodide Formula: C22H23FeIN2+2 MolecularWeight: 498.18089

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=[N+](C2=CC=CC=C2N1C[C]3[CH][CH][CH][CH]3)C.[CH]1[CH][CH][CH][CH]1.[Fe+2].[I-]

Isomeric SMILES

C/C=C/C1=[N+](C2=CC=CC=C2N1C[C]3[CH][CH][CH][CH]3)C.[CH]1[CH][CH][CH][CH]1.[Fe+2].[I-]

InChI

InChI=1S/C17H18N2.C5H5.Fe.HI/c1-3-8-17-18(2)15-11-6-7-12-16(15)19(17)13-14-9-4-5-10-14;1-2-4-5-3-1;;/h3-12H,13H2,1-2H3;1-5H;;1H/q+1;;+2;/p-1/b8-3+;;;