carbon monoxide; cyclopentane; 1-ethoxy-3a-methyl-azulen-4-one; iron

Systemtic Name: carbon monoxide; cyclopentane; 1-ethoxy-3a-methyl-azulen-4-one; iron Openeye Name: carbon monoxide; cyclopentane; 1-ethoxy-3a-methyl-azulen-4-one; iron CAS Name: carbon monoxide; cyclopentane; 1-ethoxy-3a-methyl-4-azulenone; iron IUPAC Name: carbon monoxide; cyclopentane; 1-ethoxy-3a-methylazulen-4-one; iron Traditional Name: carbon monoxide; cyclopentane; 1-ethoxy-3a-methyl-azulen-4-one; iron Formula: C23H19Fe2O7 MolecularWeight: 519.08276

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Descriptors Computed from Structure

Canonical SMILES:

CCO[C]1[CH][CH]C2([C]1[CH][CH][CH][CH]C2=O)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe].[Fe]

Isomeric SMILES

CCO[C]1[CH][CH]C2([C]1[CH][CH][CH][CH]C2=O)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe].[Fe]

InChI

InChI=1S/C13H14O2.C5H5.5CO.2Fe/c1-3-15-11-8-9-13(2)10(11)6-4-5-7-12(13)14;1-2-4-5-3-1;5*1-2;;/h4-9H,3H2,1-2H3;1-5H;;;;;;;