carbon monoxide; iron; (4E,6E)-octa-1,4,6-trien-3-one

Systemtic Name: carbon monoxide; iron; (4E,6E)-octa-1,4,6-trien-3-one Openeye Name: carbon monoxide; iron; (4E,6E)-octa-1,4,6-trien-3-one CAS Name: carbon monoxide; iron; (4E,6E)-3-octa-1,4,6-trienone IUPAC Name: carbon monoxide; iron; (4E,6E)-octa-1,4,6-trien-3-one Traditional Name: carbon monoxide; iron; (4E,6E)-octa-1,4,6-trien-3-one Formula: C11H10FeO4 MolecularWeight: 262.0397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C/C=C/C(=O)C=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C8H10O.3CO.Fe/c1-3-5-6-7-8(9)4-2;3*1-2;/h3-7H,2H2,1H3;;;;/b5-3+,7-6+;;;;