carbon monoxide; [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl phosphate; iron

Systemtic Name: carbon monoxide; [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl phosphate; iron Openeye Name: carbon monoxide; [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl phosphate; iron CAS Name: carbon monoxide; iron; phosphoric acid [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl ester IUPAC Name: carbon monoxide; [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl phosphate; iron Traditional Name: carbon monoxide; iron; phosphoric acid [(2E,4E)-1-cyanohexa-2,4-dienyl] diethyl ester Formula: C14H18FeNO7P MolecularWeight: 399.113981

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC(C=CC=CC)C#N.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCOP(=O)(OCC)OC(/C=C/C=C/C)C#N.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C11H18NO4P.3CO.Fe/c1-4-7-8-9-11(10-12)16-17(13,14-5-2)15-6-3;3*1-2;/h4,7-9,11H,5-6H2,1-3H3;;;;/b7-4+,9-8+;;;;