carbon monoxide; diphenylphosphane; ethyl but-3-enoate; iron

Systemtic Name: carbon monoxide; diphenylphosphane; ethyl but-3-enoate; iron Openeye Name: carbon monoxide; diphenylphosphane; ethyl but-3-enoate; iron CAS Name: 3-butenoic acid ethyl ester; carbon monoxide; diphenylphosphine; iron IUPAC Name: carbon monoxide; diphenylphosphane; ethyl but-3-enoate; iron Traditional Name: but-3-enoic acid ethyl ester; carbon monoxide; diphenylphosphine; iron Formula: C23H20Fe2O7P- MolecularWeight: 551.064461

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[C-]=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.[Fe].[Fe]

Isomeric SMILES

CCOC(=O)C[C-]=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.[Fe].[Fe]

InChI

InChI=1S/C12H11P.C6H9O2.5CO.2Fe/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-3-5-6(7)8-4-2;5*1-2;;/h1-10,13H;1,4-5H2,2H3;;;;;;;/q;-1;;;;;;;