1-cyclopenta-1,4-dien-1-yl-2,2-dimethyl-propan-1-one; iron(2+); 2-propylcyclopenta-1,3-diene

Systemtic Name: 1-cyclopenta-1,4-dien-1-yl-2,2-dimethyl-propan-1-one; iron(2+); 2-propylcyclopenta-1,3-diene Openeye Name: ferrous; 1-cyclopenta-1,4-dien-1-yl-2,2-dimethyl-propan-1-one; 2-propylcyclopenta-1,3-diene CAS Name: 1-(1-cyclopenta-1,4-dienyl)-2,2-dimethyl-1-propanone; iron(2+); 2-propylcyclopenta-1,3-diene IUPAC Name: 1-cyclopenta-1,4-dien-1-yl-2,2-dimethylpropan-1-one; iron(2+); 2-propylcyclopenta-1,3-diene Traditional Name: ferrous; 1-cyclopenta-1,4-dien-1-yl-2,2-dimethyl-propan-1-one; 2-propylcyclopenta-1,3-diene Formula: C18H24FeO MolecularWeight: 312.22756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[C-]CC=C1.CC(C)(C)C(=O)C1=[C-]CC=C1.[Fe+2]

Isomeric SMILES

CCCC1=[C-]CC=C1.CC(C)(C)C(=O)C1=[C-]CC=C1.[Fe+2]

InChI

InChI=1S/C10H13O.C8H11.Fe/c1-10(2,3)9(11)8-6-4-5-7-8;1-2-5-8-6-3-4-7-8;/h4,6H,5H2,1-3H3;3,6H,2,4-5H2,1H3;/q2*-1;+2