carbon monoxide; cyclopentane; iron(2+); 2-methyl-5,5-diphenyl-cyclopent-2-en-1-one

Systemtic Name: carbon monoxide; cyclopentane; iron(2+); 2-methyl-5,5-diphenyl-cyclopent-2-en-1-one Openeye Name: ferrous; carbon monoxide; cyclopentane; 2-methyl-5,5-diphenyl-cyclopent-2-en-1-one CAS Name: carbon monoxide; cyclopentane; iron(2+); 2-methyl-5,5-diphenyl-1-cyclopent-2-enone IUPAC Name: carbon monoxide; cyclopentane; iron(2+); 2-methyl-5,5-diphenylcyclopent-2-en-1-one Traditional Name: ferrous; carbon monoxide; cyclopentane; 2-methyl-5,5-diphenyl-cyclopent-2-en-1-one Formula: C25H20FeO3+ MolecularWeight: 424.2695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3.[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC1=[C-]CC(C1=O)(C2=CC=CC=C2)C3=CC=CC=C3.[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C18H15O.C5H5.2CO.Fe/c1-14-12-13-18(17(14)19,15-8-4-2-5-9-15)16-10-6-3-7-11-16;1-2-4-5-3-1;2*1-2;/h2-11H,13H2,1H3;1-5H;;;/q-1;;;;+2