cyclopentane; 2,3-di(cyclopentyl)-5-phenyl-cyclohexa-2,5-diene-1,4-dione; iron(2+)

Systemtic Name: cyclopentane; 2,3-di(cyclopentyl)-5-phenyl-cyclohexa-2,5-diene-1,4-dione; iron(2+) Openeye Name: diferrous; cyclopentane; 2,3-di(cyclopentyl)-5-phenyl-1,4-benzoquinone CAS Name: cyclopentane; 2,3-di(cyclopentyl)-5-phenylcyclohexa-2,5-diene-1,4-dione; iron(2+) IUPAC Name: cyclopentane; 2,3-di(cyclopentyl)-5-phenylcyclohexa-2,5-diene-1,4-dione; iron(2+) Traditional Name: diferrous; cyclopentane; 2,3-di(cyclopentyl)-5-phenyl-p-benzoquinone Formula: C32H24Fe2O2+4 MolecularWeight: 552.22176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)C(=C(C2=O)[C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)C(=C(C2=O)[C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C22H14O2.2C5H5.2Fe/c23-19-14-18(15-8-2-1-3-9-15)22(24)21(17-12-6-7-13-17)20(19)16-10-4-5-11-16;2*1-2-4-5-3-1;;/h1-14H;2*1-5H;;/q;;;2*+2