cyclopenta-1,3-diene; (E)-1-cyclopenta-1,3-dien-1-yl-3-pyridin-3-yl-prop-2-en-1-one; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; (E)-1-cyclopenta-1,3-dien-1-yl-3-pyridin-3-yl-prop-2-en-1-one; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; (E)-1-cyclopenta-1,3-dien-1-yl-3-(3-pyridyl)prop-2-en-1-one CAS Name: cyclopenta-1,3-diene; (E)-1-(1-cyclopenta-1,3-dienyl)-3-(3-pyridinyl)-2-propen-1-one; iron(2+) IUPAC Name: cyclopenta-1,3-diene; (E)-1-cyclopenta-1,3-dien-1-yl-3-pyridin-3-ylprop-2-en-1-one; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; (E)-1-cyclopenta-1,3-dien-1-yl-3-(3-pyridyl)prop-2-en-1-one Formula: C18H15FeNO MolecularWeight: 317.1628

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1C(=O)C=CC2=CN=CC=C2.[Fe+2]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1C(=O)/C=C/C2=CN=CC=C2.[Fe+2]

InChI

InChI=1S/C13H10NO.C5H5.Fe/c15-13(12-5-1-2-6-12)8-7-11-4-3-9-14-10-11;1-2-4-5-3-1;/h1-10H;1-5H;/q2*-1;+2/b8-7+;;