cyclopentane; 3-[4-[(E)-3-cyclopentylprop-2-enoyl]phenyl]benzaldehyde; iron(2+)

Systemtic Name: cyclopentane; 3-[4-[(E)-3-cyclopentylprop-2-enoyl]phenyl]benzaldehyde; iron(2+) Openeye Name: ferrous; cyclopentane; 3-[4-[(E)-3-cyclopentylprop-2-enoyl]phenyl]benzaldehyde CAS Name: cyclopentane; 3-[4-[(E)-3-cyclopentyl-1-oxoprop-2-enyl]phenyl]benzaldehyde; iron(2+) IUPAC Name: cyclopentane; 3-[4-[(E)-3-cyclopentylprop-2-enoyl]phenyl]benzaldehyde; iron(2+) Traditional Name: ferrous; cyclopentane; 3-[4-[(E)-3-cyclopentylacryloyl]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(=O)C=C[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(=O)/C=C/[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

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