carbon monoxide; ethyl 3-cyclohepta-2,4-dien-1-ylpropanoate; iron

Systemtic Name: carbon monoxide; ethyl 3-cyclohepta-2,4-dien-1-ylpropanoate; iron Openeye Name: carbon monoxide; ethyl 3-cyclohepta-2,4-dien-1-ylpropanoate; iron CAS Name: carbon monoxide; 3-(1-cyclohepta-2,4-dienyl)propanoic acid ethyl ester; iron IUPAC Name: carbon monoxide; ethyl 3-cyclohepta-2,4-dien-1-ylpropanoate; iron Traditional Name: carbon monoxide; 3-cyclohepta-2,4-dien-1-ylpropionic acid ethyl ester; iron Formula: C15H18FeO5 MolecularWeight: 334.14542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1CCC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCOC(=O)CCC1CCC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C12H18O2.3CO.Fe/c1-2-14-12(13)10-9-11-7-5-3-4-6-8-11;3*1-2;/h3-5,7,11H,2,6,8-10H2,1H3;;;;