carbon monoxide; iron; methyl (E)-3-cyclohexylprop-2-enoate

Systemtic Name: carbon monoxide; iron; methyl (E)-3-cyclohexylprop-2-enoate Openeye Name: carbon monoxide; iron; methyl (E)-3-cyclohexylprop-2-enoate CAS Name: carbon monoxide; (E)-3-cyclohexyl-2-propenoic acid methyl ester; iron IUPAC Name: carbon monoxide; iron; methyl (E)-3-cyclohexylprop-2-enoate Traditional Name: carbon monoxide; (E)-3-cyclohexylacrylic acid methyl ester; iron Formula: C13H12FeO5 MolecularWeight: 304.07638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C[C]1CC[CH][CH][CH]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

COC(=O)/C=C/[C]1CC[CH][CH][CH]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C10H12O2.3CO.Fe/c1-12-10(11)8-7-9-5-3-2-4-6-9;3*1-2;/h2-3,5,7-8H,4,6H2,1H3;;;;/b8-7+;;;;