cyclopentane; 4-(2-cyclopentylethynyl)-6-methyl-pyran-2-one; iron(2+)

Systemtic Name: cyclopentane; 4-(2-cyclopentylethynyl)-6-methyl-pyran-2-one; iron(2+) Openeye Name: ferrous; cyclopentane; 4-(2-cyclopentylethynyl)-6-methyl-pyran-2-one CAS Name: cyclopentane; 4-(2-cyclopentylethynyl)-6-methyl-2-pyranone; iron(2+) IUPAC Name: cyclopentane; 4-(2-cyclopentylethynyl)-6-methylpyran-2-one; iron(2+) Traditional Name: ferrous; cyclopentane; 4-(2-cyclopentylethynyl)-6-methyl-pyran-2-one Formula: C18H14FeO2+2 MolecularWeight: 318.14756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=O)O1)C#C[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC1=CC(=CC(=O)O1)C#C[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C13H9O2.C5H5.Fe/c1-10-8-12(9-13(14)15-10)7-6-11-4-2-3-5-11;1-2-4-5-3-1;/h2-5,8-9H,1H3;1-5H;/q;;+2