carbon monoxide; iron(2+); methyl (Z)-hept-5-enoate

Systemtic Name: carbon monoxide; iron(2+); methyl (Z)-hept-5-enoate Openeye Name: ferrous; carbon monoxide; methyl (Z)-hept-5-enoate CAS Name: carbon monoxide; (Z)-5-heptenoic acid methyl ester; iron(2+) IUPAC Name: carbon monoxide; iron(2+); methyl (Z)-hept-5-enoate Traditional Name: ferrous; carbon monoxide; (Z)-hept-5-enoic acid methyl ester Formula: C11H12FeO5 MolecularWeight: 280.05498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[CH-]CCC=C[CH2-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

Isomeric SMILES

COC(=O)[CH-]CC/C=C\[CH2-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

InChI

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