cyclopenta-1,3-diene; (E)-3-cyclopenta-2,4-dien-1-ylprop-2-enoic acid; iron

Systemtic Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-2,4-dien-1-ylprop-2-enoic acid; iron Openeye Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-2,4-dien-1-ylprop-2-enoic acid; iron CAS Name: cyclopenta-1,3-diene; (E)-3-(1-cyclopenta-2,4-dienyl)-2-propenoic acid; iron IUPAC Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-2,4-dien-1-ylprop-2-enoic acid; iron Traditional Name: cyclopenta-1,3-diene; (E)-3-cyclopenta-2,4-dien-1-ylacrylic acid; iron Formula: C13H12FeO2-2 MolecularWeight: 256.07818

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=C[C-](C=C1)C=CC(=O)O.[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.C1=C[C-](C=C1)/C=C/C(=O)O.[Fe]

InChI

InChI=1S/C8H7O2.C5H5.Fe/c9-8(10)6-5-7-3-1-2-4-7;1-2-4-5-3-1;/h1-6H,(H,9,10);1-5H;/q2*-1;/b6-5+;;