cyclopenta-1,3-diene; 2-(2-cyclopenta-2,4-dien-1-yl-2-oxidanylidene-ethyl)benzoic acid; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; 2-(2-cyclopenta-2,4-dien-1-yl-2-oxidanylidene-ethyl)benzoic acid; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; 2-(2-cyclopenta-2,4-dien-1-yl-2-oxo-ethyl)benzoic acid CAS Name: cyclopenta-1,3-diene; 2-[2-(1-cyclopenta-2,4-dienyl)-2-oxoethyl]benzoic acid; iron(2+) IUPAC Name: cyclopenta-1,3-diene; 2-(2-cyclopenta-2,4-dien-1-yl-2-oxoethyl)benzoic acid; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; 2-(2-cyclopenta-2,4-dien-1-yl-2-keto-ethyl)benzoic acid Formula: C19H16FeO3 MolecularWeight: 348.17354

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=CC=C(C(=C1)CC(=O)C2C=C[C-]=C2)C(=O)O.[Fe+2]

Isomeric SMILES

[CH-]1C=CC=C1.C1=CC=C(C(=C1)CC(=O)C2C=C[C-]=C2)C(=O)O.[Fe+2]

InChI

InChI=1S/C14H11O3.C5H5.Fe/c15-13(10-5-1-2-6-10)9-11-7-3-4-8-12(11)14(16)17;1-2-4-5-3-1;/h1,3-8,10H,9H2,(H,16,17);1-5H;/q2*-1;+2