cyclopentane; (E)-3-cyclopentyl-2-(3-oxidanylpropoxymethyl)prop-2-enenitrile; iron(2+)

Systemtic Name: cyclopentane; (E)-3-cyclopentyl-2-(3-oxidanylpropoxymethyl)prop-2-enenitrile; iron(2+) Openeye Name: ferrous; cyclopentane; (E)-3-cyclopentyl-2-(3-hydroxypropoxymethyl)prop-2-enenitrile CAS Name: cyclopentane; (E)-3-cyclopentyl-2-(3-hydroxypropoxymethyl)-2-propenenitrile; iron(2+) IUPAC Name: cyclopentane; (E)-3-cyclopentyl-2-(3-hydroxypropoxymethyl)prop-2-enenitrile; iron(2+) Traditional Name: ferrous; cyclopentane; (E)-3-cyclopentyl-2-(3-hydroxypropoxymethyl)acrylonitrile Formula: C17H19FeNO2+2 MolecularWeight: 325.18326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)/C=C(/COCCCO)\C#N.[Fe+2]

InChI

InChI=1S/C12H14NO2.C5H5.Fe/c13-9-12(10-15-7-3-6-14)8-11-4-1-2-5-11;1-2-4-5-3-1;/h1-2,4-5,8,14H,3,6-7,10H2;1-5H;/q;;+2