cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-oxidanylidene-prop-1-enyl]phenyl]benzaldehyde; iron(2+)

Systemtic Name: cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-oxidanylidene-prop-1-enyl]phenyl]benzaldehyde; iron(2+) Openeye Name: ferrous; cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-oxo-prop-1-enyl]phenyl]benzaldehyde CAS Name: cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-oxoprop-1-enyl]phenyl]benzaldehyde; iron(2+) IUPAC Name: cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-oxoprop-1-enyl]phenyl]benzaldehyde; iron(2+) Traditional Name: ferrous; cyclopentane; 3-[3-[(E)-3-cyclopentyl-3-keto-prop-1-enyl]phenyl]benzaldehyde Formula: C26H20FeO2+2 MolecularWeight: 420.2808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/C(=O)[C]2[CH][CH][CH][CH]2)C3=CC(=CC=C3)C=O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C21H15O2.C5H5.Fe/c22-15-17-6-4-10-20(14-17)19-9-3-5-16(13-19)11-12-21(23)18-7-1-2-8-18;1-2-4-5-3-1;/h1-15H;1-5H;/q;;+2/b12-11+;;