cyclopenta-1,3-diene; 2-cyclopenta-1,4-dien-1-yl-5-methyl-5-(2-methylpentan-2-ylperoxy)hex-3-yn-2-ol; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; 2-cyclopenta-1,4-dien-1-yl-5-methyl-5-(2-methylpentan-2-ylperoxy)hex-3-yn-2-ol; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; 2-cyclopenta-1,4-dien-1-yl-5-(1,1-dimethylbutylperoxy)-5-methyl-hex-3-yn-2-ol CAS Name: cyclopenta-1,3-diene; 2-(1-cyclopenta-1,4-dienyl)-5-methyl-5-(2-methylpentan-2-yldioxy)-3-hexyn-2-ol; iron(2+) IUPAC Name: cyclopenta-1,3-diene; 2-cyclopenta-1,4-dien-1-yl-5-methyl-5-(2-methylpentan-2-ylperoxy)hex-3-yn-2-ol; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; 2-cyclopenta-1,4-dien-1-yl-5-(1,1-dimethylbutylperoxy)-5-methyl-hex-3-yn-2-ol Formula: C23H32FeO3 MolecularWeight: 412.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)OOC(C)(C)C#CC(C)(C1=C[CH-]C=C1)O.[CH-]1C=CC=C1.[Fe+2]

Isomeric SMILES

CCCC(C)(C)OOC(C)(C)C#CC(C)(C1=C[CH-]C=C1)O.[CH-]1C=CC=C1.[Fe+2]

InChI

InChI=1S/C18H27O3.C5H5.Fe/c1-7-12-16(2,3)20-21-17(4,5)13-14-18(6,19)15-10-8-9-11-15;1-2-4-5-3-1;/h8-11,19H,7,12H2,1-6H3;1-5H;/q2*-1;+2