cyclopentane; 3-cyclopentyl-2,4,5-triphenyl-cyclopenta-2,4-dien-1-one; iron(2+)

Systemtic Name: cyclopentane; 3-cyclopentyl-2,4,5-triphenyl-cyclopenta-2,4-dien-1-one; iron(2+) Openeye Name: ferrous; cyclopentane; 3-cyclopentyl-2,4,5-triphenyl-cyclopenta-2,4-dien-1-one CAS Name: cyclopentane; 3-cyclopentyl-2,4,5-triphenyl-1-cyclopenta-2,4-dienone; iron(2+) IUPAC Name: cyclopentane; 3-cyclopentyl-2,4,5-triphenylcyclopenta-2,4-dien-1-one; iron(2+) Traditional Name: ferrous; cyclopentane; 3-cyclopentyl-2,4,5-triphenyl-cyclopenta-2,4-dien-1-one Formula: C33H24FeO+2 MolecularWeight: 492.38806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C(=C2[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4)C5=CC=CC=C5.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C(=C2[C]3[CH][CH][CH][CH]3)C4=CC=CC=C4)C5=CC=CC=C5.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C28H19O.C5H5.Fe/c29-28-26(22-14-6-2-7-15-22)24(20-12-4-1-5-13-20)25(21-18-10-11-19-21)27(28)23-16-8-3-9-17-23;1-2-4-5-3-1;/h1-19H;1-5H;/q;;+2