carbon monoxide; iron; methyl (3E)-2-prop-2-enylhexa-3,5-dienoate

Systemtic Name: carbon monoxide; iron; methyl (3E)-2-prop-2-enylhexa-3,5-dienoate Openeye Name: carbon monoxide; iron; methyl (3E)-2-allylhexa-3,5-dienoate CAS Name: carbon monoxide; iron; (3E)-2-prop-2-enylhexa-3,5-dienoic acid methyl ester IUPAC Name: carbon monoxide; iron; methyl (3E)-2-prop-2-enylhexa-3,5-dienoate Traditional Name: (3E)-2-allylhexa-3,5-dienoic acid methyl ester; carbon monoxide; iron Formula: C13H14FeO5 MolecularWeight: 306.09226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O2.3CO.Fe/c1-4-6-8-9(7-5-2)10(11)12-3;3*1-2;/h4-6,8-9H,1-2,7H2,3H3;;;;/b8-6+;;;;