1-cyclopentylethanone; ethyl 2-cyclopentylethanoate; iron

Systemtic Name: 1-cyclopentylethanone; ethyl 2-cyclopentylethanoate; iron Openeye Name: 1-cyclopentylethanone; ethyl 2-cyclopentylacetate; iron CAS Name: 2-cyclopentylacetic acid ethyl ester; 1-cyclopentylethanone; iron IUPAC Name: 1-cyclopentylethanone; ethyl 2-cyclopentylacetate; iron Traditional Name: 2-cyclopentylacetic acid ethyl ester; 1-cyclopentylethanone; iron Formula: C16H18FeO3 MolecularWeight: 314.15732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[C]1[CH][CH][CH][CH]1.CC(=O)[C]1[CH][CH][CH][CH]1.[Fe]

Isomeric SMILES

CCOC(=O)C[C]1[CH][CH][CH][CH]1.CC(=O)[C]1[CH][CH][CH][CH]1.[Fe]

InChI

InChI=1S/C9H11O2.C7H7O.Fe/c1-2-11-9(10)7-8-5-3-4-6-8;1-6(8)7-4-2-3-5-7;/h3-6H,2,7H2,1H3;2-5H,1H3;