cyclopentane; iron(2+); 1-[2-(1-oxidanylpropyl)cyclopentyl]pentan-1-one

Systemtic Name: cyclopentane; iron(2+); 1-[2-(1-oxidanylpropyl)cyclopentyl]pentan-1-one Openeye Name: ferrous; cyclopentane; 1-[2-(1-hydroxypropyl)cyclopentyl]pentan-1-one CAS Name: cyclopentane; 1-[2-(1-hydroxypropyl)cyclopentyl]-1-pentanone; iron(2+) IUPAC Name: cyclopentane; 1-[2-(1-hydroxypropyl)cyclopentyl]pentan-1-one; iron(2+) Traditional Name: ferrous; cyclopentane; 1-[2-(1-hydroxypropyl)cyclopentyl]pentan-1-one Formula: C18H24FeO2+2 MolecularWeight: 328.22696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19O2.C5H5.Fe/c1-3-5-9-13(15)11-8-6-7-10(11)12(14)4-2;1-2-4-5-3-1;/h6-8,12,14H,3-5,9H2,1-2H3;1-5H;/q;;+2