cyclopentane; 3-[4-[(E)-3-cyclopentyl-3-oxidanylidene-prop-1-enyl]phenyl]benzaldehyde; iron(2+)

Systemtic Name: cyclopentane; 3-[4-[(E)-3-cyclopentyl-3-oxidanylidene-prop-1-enyl]phenyl]benzaldehyde; iron(2+) Openeye Name: ferrous; cyclopentane; 3-[4-[(E)-3-cyclopentyl-3-oxo-prop-1-enyl]phenyl]benzaldehyde CAS Name: cyclopentane; 3-[4-[(E)-3-cyclopentyl-3-oxoprop-1-enyl]phenyl]benzaldehyde; iron(2+) IUPAC Name: cyclopentane; 3-[4-[(E)-3-cyclopentyl-3-oxoprop-1-enyl]phenyl]benzaldehyde; iron(2+) Traditional Name: ferrous; cyclopentane; 3-[4-[(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=O)C2=CC=C(C=C2)C=CC(=O)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

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

InChI

InChI=1S/C21H15O2.C5H5.Fe/c22-15-17-4-3-7-20(14-17)18-11-8-16(9-12-18)10-13-21(23)19-5-1-2-6-19;1-2-4-5-3-1;/h1-15H;1-5H;/q;;+2/b13-10+;;