carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethyl-cyclohexa-1,3-diene; iron

Systemtic Name: carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethyl-cyclohexa-1,3-diene; iron Openeye Name: carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethyl-cyclohexa-1,3-diene; iron CAS Name: carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethylcyclohexa-1,3-diene; iron IUPAC Name: carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethylcyclohexa-1,3-diene; iron Traditional Name: carbon monoxide; (5R,6R)-1-ethyl-5,6-dimethyl-cyclohexa-1,3-diene; iron Formula: C13H16FeO3 MolecularWeight: 276.10934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(C1C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCC1=CC=C[C@H]([C@H]1C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C10H16.3CO.Fe/c1-4-10-7-5-6-8(2)9(10)3;3*1-2;/h5-9H,4H2,1-3H3;;;;/t8-,9-;;;;/m1..../s1