carbon monoxide; iron; 6-methylidene-5-oxidanyl-oct-7-enenitrile

Systemtic Name: carbon monoxide; iron; 6-methylidene-5-oxidanyl-oct-7-enenitrile Openeye Name: carbon monoxide; 5-hydroxy-6-methylene-oct-7-enenitrile; iron CAS Name: carbon monoxide; 5-hydroxy-6-methylene-7-octenenitrile; iron IUPAC Name: carbon monoxide; 5-hydroxy-6-methylideneoct-7-enenitrile; iron Traditional Name: carbon monoxide; 5-hydroxy-6-methylene-oct-7-enenitrile; iron Formula: C12H13FeNO4 MolecularWeight: 291.08092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO.3CO.Fe/c1-3-8(2)9(11)6-4-5-7-10;3*1-2;/h3,9,11H,1-2,4-6H2;;;;