carbon monoxide; iron; methyl (2S)-2-(hexanoylamino)-4-methyl-pentanoate

Systemtic Name: carbon monoxide; iron; methyl (2S)-2-(hexanoylamino)-4-methyl-pentanoate Openeye Name: carbon monoxide; iron; methyl (2S)-2-(hexanoylamino)-4-methyl-pentanoate CAS Name: carbon monoxide; iron; (2S)-4-methyl-2-(1-oxohexylamino)pentanoic acid methyl ester IUPAC Name: carbon monoxide; iron; methyl (2S)-2-(hexanoylamino)-4-methylpentanoate Traditional Name: carbon monoxide; (2S)-2-(hexanoylamino)-4-methyl-valeric acid methyl ester; iron Formula: C16H21FeNO6 MolecularWeight: 379.18604

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Descriptors Computed from Structure

Canonical SMILES:

C[CH][CH][CH][CH]C(=O)NC(CC(C)C)C(=O)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

C[CH][CH][CH][CH]C(=O)N[C@@H](CC(C)C)C(=O)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C13H21NO3.3CO.Fe/c1-5-6-7-8-12(15)14-11(9-10(2)3)13(16)17-4;3*1-2;/h5-8,10-11H,9H2,1-4H3,(H,14,15);;;;/t11-;;;;/m0..../s1