4-[(E)-2-cyano-3-cyclopentyl-prop-2-enoyl]benzene-1,2-diolate; cyclopentane; iron(2+)

Systemtic Name: 4-[(E)-2-cyano-3-cyclopentyl-prop-2-enoyl]benzene-1,2-diolate; cyclopentane; iron(2+) Openeye Name: ferrous; 4-[(E)-2-cyano-3-cyclopentyl-prop-2-enoyl]benzene-1,2-diolate; cyclopentane CAS Name: 4-[(E)-2-cyano-3-cyclopentyl-1-oxoprop-2-enyl]benzene-1,2-diolate; cyclopentane; iron(2+) IUPAC Name: 4-[(E)-2-cyano-3-cyclopentylprop-2-enoyl]benzene-1,2-diolate; cyclopentane; iron(2+) Traditional Name: ferrous; 4-[(E)-2-cyano-3-cyclopentyl-acryloyl]benzene-1,2-diolate; cyclopentane Formula: C20H13FeNO3 MolecularWeight: 371.16712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)C(=C[C]2[CH][CH][CH][CH]2)C#N)[O-])[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)/C(=C/[C]2[CH][CH][CH][CH]2)/C#N)[O-])[O-].[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C15H10NO3.C5H5.Fe/c16-9-12(7-10-3-1-2-4-10)15(19)11-5-6-13(17)14(18)8-11;1-2-4-5-3-1;/h1-8,17-18H;1-5H;/q;;+2/p-2