(E)-1-cyclopentyl-3-(3-methoxyphenyl)prop-2-en-1-one; iron(2+)

Systemtic Name: (E)-1-cyclopentyl-3-(3-methoxyphenyl)prop-2-en-1-one; iron(2+) Openeye Name: ferrous (E)-1-cyclopentyl-3-(3-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-cyclopentyl-3-(3-methoxyphenyl)-2-propen-1-one; iron(2+) IUPAC Name: (E)-1-cyclopentyl-3-(3-methoxyphenyl)prop-2-en-1-one; iron(2+) Traditional Name: ferrous (E)-1-cyclopentyl-3-(3-methoxyphenyl)prop-2-en-1-one Formula: C30H26FeO4+2 MolecularWeight: 506.37004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)[C]2[CH][CH][CH][CH]2.COC1=CC=CC(=C1)C=CC(=O)[C]2[CH][CH][CH][CH]2.[Fe+2]

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)[C]2[CH][CH][CH][CH]2.COC1=CC=CC(=C1)/C=C/C(=O)[C]2[CH][CH][CH][CH]2.[Fe+2]

InChI

InChI=1S/2C15H13O2.Fe/c2*1-17-14-8-4-5-12(11-14)9-10-15(16)13-6-2-3-7-13;/h2*2-11H,1H3;/q;;+2/b2*10-9+;