carbon monoxide; iron; (3Z)-nona-1,3-dien-5-one

Systemtic Name: carbon monoxide; iron; (3Z)-nona-1,3-dien-5-one Openeye Name: carbon monoxide; iron; (3Z)-nona-1,3-dien-5-one CAS Name: carbon monoxide; iron; (3Z)-5-nona-1,3-dienone IUPAC Name: carbon monoxide; iron; (3Z)-nona-1,3-dien-5-one Traditional Name: carbon monoxide; iron; (3Z)-nona-1,3-dien-5-one Formula: C12H14FeO4 MolecularWeight: 278.08216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14O.3CO.Fe/c1-3-5-7-9(10)8-6-4-2;3*1-2;/h3,5,7H,1,4,6,8H2,2H3;;;;/b7-5-;;;;