iron(2+); methyl (E)-2-cyano-3-cyclopentyl-prop-2-enoate

Systemtic Name: iron(2+); methyl (E)-2-cyano-3-cyclopentyl-prop-2-enoate Openeye Name: ferrous methyl (E)-2-cyano-3-cyclopentyl-prop-2-enoate CAS Name: (E)-2-cyano-3-cyclopentyl-2-propenoic acid methyl ester; iron(2+) IUPAC Name: iron(2+); methyl (E)-2-cyano-3-cyclopentylprop-2-enoate Traditional Name: ferrous (E)-2-cyano-3-cyclopentyl-acrylic acid methyl ester Formula: C20H16FeN2O4+2 MolecularWeight: 404.19704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C[C]1[CH][CH][CH][CH]1)C#N.COC(=O)C(=C[C]1[CH][CH][CH][CH]1)C#N.[Fe+2]

Isomeric SMILES

COC(=O)/C(=C/[C]1[CH][CH][CH][CH]1)/C#N.COC(=O)/C(=C/[C]1[CH][CH][CH][CH]1)/C#N.[Fe+2]

InChI

InChI=1S/2C10H8NO2.Fe/c2*1-13-10(12)9(7-11)6-8-4-2-3-5-8;/h2*2-6H,1H3;/q;;+2