(5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron

Systemtic Name: (5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron Openeye Name: (5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron CAS Name: (5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron IUPAC Name: (5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron Traditional Name: (5E)-5-butylidenecyclohexa-1,3-diene; carbon monoxide; iron Formula: C13H14FeO3 MolecularWeight: 274.09346

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C1CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CCC/C=C/1\CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C10H14.3CO.Fe/c1-2-3-7-10-8-5-4-6-9-10;3*1-2;/h4-8H,2-3,9H2,1H3;;;;/b10-7-;;;;