carbon monoxide; iron; (3E,5E)-1-methoxyhepta-3,5-dien-2-one

Systemtic Name: carbon monoxide; iron; (3E,5E)-1-methoxyhepta-3,5-dien-2-one Openeye Name: carbon monoxide; iron; (3E,5E)-1-methoxyhepta-3,5-dien-2-one CAS Name: carbon monoxide; iron; (3E,5E)-1-methoxy-2-hepta-3,5-dienone IUPAC Name: carbon monoxide; iron; (3E,5E)-1-methoxyhepta-3,5-dien-2-one Traditional Name: carbon monoxide; iron; (3E,5E)-1-methoxyhepta-3,5-dien-2-one Formula: C11H12FeO5 MolecularWeight: 280.05498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H12O2.3CO.Fe/c1-3-4-5-6-8(9)7-10-2;3*1-2;/h3-6H,7H2,1-2H3;;;;/b4-3+,6-5+;;;;