carbon monoxide; iron; methyl (3E)-hexa-3,5-dienoate

Systemtic Name: carbon monoxide; iron; methyl (3E)-hexa-3,5-dienoate Openeye Name: carbon monoxide; iron; methyl (3E)-hexa-3,5-dienoate CAS Name: carbon monoxide; (3E)-hexa-3,5-dienoic acid methyl ester; iron IUPAC Name: carbon monoxide; iron; methyl (3E)-hexa-3,5-dienoate Traditional Name: carbon monoxide; (3E)-hexa-3,5-dienoic acid methyl ester; iron Formula: C10H10FeO5 MolecularWeight: 266.0284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H10O2.3CO.Fe/c1-3-4-5-6-7(8)9-2;3*1-2;/h3-5H,1,6H2,2H3;;;;/b5-4+;;;;