carbon monoxide; iron; 6-oxidanyl-6-propan-2-yl-cyclohepta-2,4-dien-1-one

Systemtic Name: carbon monoxide; iron; 6-oxidanyl-6-propan-2-yl-cyclohepta-2,4-dien-1-one Openeye Name: carbon monoxide; 6-hydroxy-6-isopropyl-cyclohepta-2,4-dien-1-one; iron CAS Name: carbon monoxide; 6-hydroxy-6-propan-2-yl-1-cyclohepta-2,4-dienone; iron IUPAC Name: carbon monoxide; 6-hydroxy-6-propan-2-ylcyclohepta-2,4-dien-1-one; iron Traditional Name: carbon monoxide; 6-hydroxy-6-isopropyl-cyclohepta-2,4-dien-1-one; iron Formula: C13H14FeO5 MolecularWeight: 306.09226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O2.3CO.Fe/c1-8(2)10(12)6-4-3-5-9(11)7-10;3*1-2;/h3-6,8,12H,7H2,1-2H3;;;;