1-cyclopenta-1,4-dien-1-ylethanone; 3-cyclopenta-1,4-dien-1-ylpropanoic acid; iron(2+)

Systemtic Name: 1-cyclopenta-1,4-dien-1-ylethanone; 3-cyclopenta-1,4-dien-1-ylpropanoic acid; iron(2+) Openeye Name: ferrous; 1-cyclopenta-1,4-dien-1-ylethanone; 3-cyclopenta-1,4-dien-1-ylpropanoic acid CAS Name: 1-(1-cyclopenta-1,4-dienyl)ethanone; 3-(1-cyclopenta-1,4-dienyl)propanoic acid; iron(2+) IUPAC Name: 1-cyclopenta-1,4-dien-1-ylethanone; 3-cyclopenta-1,4-dien-1-ylpropanoic acid; iron(2+) Traditional Name: ferrous; 1-cyclopenta-1,4-dien-1-ylethanone; 3-cyclopenta-1,4-dien-1-ylpropionic acid Formula: C15H16FeO3 MolecularWeight: 300.13074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=[C-]CC=C1.C1C=CC(=[C-]1)CCC(=O)O.[Fe+2]

Isomeric SMILES

CC(=O)C1=[C-]CC=C1.C1C=CC(=[C-]1)CCC(=O)O.[Fe+2]

InChI

InChI=1S/C8H9O2.C7H7O.Fe/c9-8(10)6-5-7-3-1-2-4-7;1-6(8)7-4-2-3-5-7;/h1,3H,2,5-6H2,(H,9,10);2,4H,3H2,1H3;/q2*-1;+2