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

Systemtic Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-1,3-dien-1-yl-1-(2-phenylmethoxyphenyl)prop-2-en-1-one; iron(2+) Openeye Name: ferrous; (E)-1-(2-benzyloxyphenyl)-3-cyclopenta-1,3-dien-1-yl-prop-2-en-1-one; cyclopenta-1,3-diene CAS Name: cyclopenta-1,3-diene; (E)-3-(1-cyclopenta-1,3-dienyl)-1-(2-phenylmethoxyphenyl)-2-propen-1-one; iron(2+) IUPAC Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-1,3-dien-1-yl-1-(2-phenylmethoxyphenyl)prop-2-en-1-one; iron(2+) Traditional Name: ferrous; (E)-1-(2-benzoxyphenyl)-3-cyclopenta-1,3-dien-1-yl-prop-2-en-1-one; cyclopenta-1,3-diene Formula: C26H22FeO2 MolecularWeight: 422.29668

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1C=CC(=O)C2=CC=CC=C2OCC3=CC=CC=C3.[Fe+2]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1/C=C/C(=O)C2=CC=CC=C2OCC3=CC=CC=C3.[Fe+2]

InChI

InChI=1S/C21H17O2.C5H5.Fe/c22-20(15-14-17-8-4-5-9-17)19-12-6-7-13-21(19)23-16-18-10-2-1-3-11-18;1-2-4-5-3-1;/h1-15H,16H2;1-5H;/q2*-1;+2/b15-14+;;