(E)-3-chloranyl-3-cyclopentyl-prop-2-enal; cyclopentane; iron

Systemtic Name: (E)-3-chloranyl-3-cyclopentyl-prop-2-enal; cyclopentane; iron Openeye Name: (E)-3-chloro-3-cyclopentyl-prop-2-enal; cyclopentane; iron CAS Name: (E)-3-chloro-3-cyclopentyl-2-propenal; cyclopentane; iron IUPAC Name: (E)-3-chloro-3-cyclopentylprop-2-enal; cyclopentane; iron Traditional Name: (E)-3-chloro-3-cyclopentyl-acrolein; cyclopentane; iron Formula: C13H11ClFeO MolecularWeight: 274.52384

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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(=CC=O)Cl.[Fe]

Isomeric SMILES

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)/C(=C\C=O)/Cl.[Fe]

InChI

InChI=1S/C8H6ClO.C5H5.Fe/c9-8(5-6-10)7-3-1-2-4-7;1-2-4-5-3-1;/h1-6H;1-5H;