carbon monoxide; 1-cyclohexa-1,3-dien-1-ylethanone; iron

Systemtic Name: carbon monoxide; 1-cyclohexa-1,3-dien-1-ylethanone; iron Openeye Name: carbon monoxide; 1-cyclohexa-1,3-dien-1-ylethanone; iron CAS Name: carbon monoxide; 1-(1-cyclohexa-1,3-dienyl)ethanone; iron IUPAC Name: carbon monoxide; 1-cyclohexa-1,3-dien-1-ylethanone; iron Traditional Name: carbon monoxide; 1-cyclohexa-1,3-dien-1-ylethanone; iron Formula: C11H10FeO4 MolecularWeight: 262.0397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CC(=O)C1=CC=CCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C8H10O.3CO.Fe/c1-7(9)8-5-3-2-4-6-8;3*1-2;/h2-3,5H,4,6H2,1H3;;;;