carbon monoxide; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene

Systemtic Name: carbon monoxide; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene Openeye Name: ferrous; carbon monoxide; 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene CAS Name: carbon monoxide; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene IUPAC Name: carbon monoxide; iron(2+); 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene Traditional Name: ferrous; carbon monoxide; 1,2,3,4,5-pentamethylcyclopentane; trimethoxymethylbenzene Formula: C21H28FeO4+ MolecularWeight: 400.28962

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Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.COC(C1=CC=CC=[C-]1)(OC)OC.[C-]#[O+].[Fe+2]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.COC(C1=CC=CC=[C-]1)(OC)OC.[C-]#[O+].[Fe+2]

InChI

InChI=1S/C10H13O3.C10H15.CO.Fe/c1-11-10(12-2,13-3)9-7-5-4-6-8-9;1-6-7(2)9(4)10(5)8(6)3;1-2;/h4-7H,1-3H3;1-5H3;;/q-1;;;+2