carbon monoxide; iron(2+); methyl (E)-6-methanidylhept-5-enoate

Systemtic Name: carbon monoxide; iron(2+); methyl (E)-6-methanidylhept-5-enoate Openeye Name: ferrous; carbon monoxide; methyl (E)-6-methanidylhept-5-enoate CAS Name: carbon monoxide; iron(2+); (E)-6-methanidyl-5-heptenoic acid methyl ester IUPAC Name: carbon monoxide; iron(2+); methyl (E)-6-methanidylhept-5-enoate Traditional Name: ferrous; carbon monoxide; (E)-6-methanidylhept-5-enoic acid methyl ester Formula: C12H14FeO5 MolecularWeight: 294.08156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14O2.3CO.Fe/c1-8(2)6-4-5-7-9(10)11-3;3*1-2;/h6-7H,1,4-5H2,2-3H3;;;;/q-2;;;;+2/b8-6+;;;;