carbon monoxide; (4,4-dimethylcyclohexa-1,5-dien-1-yl) diethyl phosphate; iron

Systemtic Name: carbon monoxide; (4,4-dimethylcyclohexa-1,5-dien-1-yl) diethyl phosphate; iron Openeye Name: carbon monoxide; (4,4-dimethylcyclohexa-1,5-dien-1-yl) diethyl phosphate; iron CAS Name: carbon monoxide; iron; phosphoric acid (4,4-dimethyl-1-cyclohexa-1,5-dienyl) diethyl ester IUPAC Name: carbon monoxide; (4,4-dimethylcyclohexa-1,5-dien-1-yl) diethyl phosphate; iron Traditional Name: carbon monoxide; iron; phosphoric acid (4,4-dimethylcyclohexa-1,5-dien-1-yl) diethyl ester Formula: C15H21FeO7P MolecularWeight: 400.141801

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OC1=CCC(C=C1)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCOP(=O)(OCC)OC1=CCC(C=C1)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C12H21O4P.3CO.Fe/c1-5-14-17(13,15-6-2)16-11-7-9-12(3,4)10-8-11;3*1-2;/h7-9H,5-6,10H2,1-4H3;;;;