carbon monoxide; (1R,7S)-1-cyclohexyl-1-oxidanyl-7-(oxidanylidenemethoxy)dodecan-3-one; iron(2+)

Systemtic Name: carbon monoxide; (1R,7S)-1-cyclohexyl-1-oxidanyl-7-(oxidanylidenemethoxy)dodecan-3-one; iron(2+) Openeye Name: ferrous; carbon monoxide; (1R,7S)-1-cyclohexyl-1-hydroxy-7-(oxomethoxy)dodecan-3-one CAS Name: carbon monoxide; (1R,7S)-1-cyclohexyl-1-hydroxy-7-(oxomethoxy)-3-dodecanone; iron(2+) IUPAC Name: carbon monoxide; (1R,7S)-1-cyclohexyl-1-hydroxy-7-(oxomethoxy)dodecan-3-one; iron(2+) Traditional Name: ferrous; carbon monoxide; (1R,7S)-1-cyclohexyl-1-hydroxy-7-(ketomethoxy)dodecan-3-one Formula: C22H30FeO7+ MolecularWeight: 462.3144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC([CH][CH][CH]C(=O)CC(C1CCCCC1)O)O[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

Isomeric SMILES

CCCCC[C@H]([CH][CH][CH]C(=O)C[C@H](C1CCCCC1)O)O[C-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe+2]

InChI

InChI=1S/C19H30O4.3CO.Fe/c1-2-3-5-12-18(23-15-20)13-8-11-17(21)14-19(22)16-9-6-4-7-10-16;3*1-2;/h8,11,13,16,18-19,22H,2-7,9-10,12,14H2,1H3;;;;/q-1;;;;+2/t18-,19-;;;;/m1..../s1