butyl 2-acetyloxybenzoate; carbon monoxide; iron(2+)

Systemtic Name: butyl 2-acetyloxybenzoate; carbon monoxide; iron(2+) Openeye Name: ferrous; butyl 2-acetoxybenzoate; carbon monoxide CAS Name: 2-acetyloxybenzoic acid butyl ester; carbon monoxide; iron(2+) IUPAC Name: butyl 2-acetyloxybenzoate; carbon monoxide; iron(2+) Traditional Name: ferrous; 2-acetoxybenzoic acid butyl ester; carbon monoxide Formula: C16H12FeO7+2 MolecularWeight: 372.10728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O[CH][CH][CH][CH2].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O[CH][CH][CH][CH2].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

InChI

InChI=1S/C13H12O4.3CO.Fe/c1-3-4-9-16-13(15)11-7-5-6-8-12(11)17-10(2)14;3*1-2;/h3-9H,1H2,2H3;;;;/q;;;;+2