carbon monoxide; iron; (5S)-5-(oxidanylidenemethoxy)-1-phenyl-hexan-1-one

Systemtic Name: carbon monoxide; iron; (5S)-5-(oxidanylidenemethoxy)-1-phenyl-hexan-1-one Openeye Name: carbon monoxide; iron; (5S)-5-(oxomethoxy)-1-phenyl-hexan-1-one CAS Name: carbon monoxide; iron; (5S)-5-(oxomethoxy)-1-phenyl-1-hexanone IUPAC Name: carbon monoxide; iron; (5S)-5-(oxomethoxy)-1-phenylhexan-1-one Traditional Name: carbon monoxide; iron; (5S)-5-(ketomethoxy)-1-phenyl-hexan-1-one Formula: C16H12FeO6- MolecularWeight: 356.10788

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Descriptors Computed from Structure

Canonical SMILES:

CC([CH][CH][CH]C(=O)C1=CC=CC=C1)O[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

C[C@@H]([CH][CH][CH]C(=O)C1=CC=CC=C1)O[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C13H12O3.3CO.Fe/c1-11(16-10-14)6-5-9-13(15)12-7-3-2-4-8-12;3*1-2;/h2-9,11H,1H3;;;;/q-1;;;;/t11-;;;;/m0..../s1