cyclopentane; iron(2+); [2-(1-oxidanylpropyl)cyclopentyl]-phenyl-methanone

Systemtic Name: cyclopentane; iron(2+); [2-(1-oxidanylpropyl)cyclopentyl]-phenyl-methanone Openeye Name: ferrous; cyclopentane; [2-(1-hydroxypropyl)cyclopentyl]-phenyl-methanone CAS Name: cyclopentane; [2-(1-hydroxypropyl)cyclopentyl]-phenylmethanone; iron(2+) IUPAC Name: cyclopentane; [2-(1-hydroxypropyl)cyclopentyl]-phenylmethanone; iron(2+) Traditional Name: ferrous; cyclopentane; [2-(1-hydroxypropyl)cyclopentyl]-phenyl-methanone Formula: C20H20FeO2+2 MolecularWeight: 348.2166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC([C]1[CH][CH][CH][C]1C(=O)C2=CC=CC=C2)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CCC([C]1[CH][CH][CH][C]1C(=O)C2=CC=CC=C2)O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C15H15O2.C5H5.Fe/c1-2-14(16)12-9-6-10-13(12)15(17)11-7-4-3-5-8-11;1-2-4-5-3-1;/h3-10,14,16H,2H2,1H3;1-5H;/q;;+2