5-bromanylcyclopenta-1,3-diene; iron; N-(3-methyl-1-oxidanyl-butan-2-yl)cyclopenta-2,4-diene-1-carboxamide

Systemtic Name: 5-bromanylcyclopenta-1,3-diene; iron; N-(3-methyl-1-oxidanyl-butan-2-yl)cyclopenta-2,4-diene-1-carboxamide Openeye Name: 5-bromocyclopenta-1,3-diene; N-[1-(hydroxymethyl)-2-methyl-propyl]cyclopenta-2,4-diene-1-carboxamide; iron CAS Name: 5-bromocyclopenta-1,3-diene; N-(1-hydroxy-3-methylbutan-2-yl)-1-cyclopenta-2,4-dienecarboxamide; iron IUPAC Name: 5-bromocyclopenta-1,3-diene; N-(1-hydroxy-3-methylbutan-2-yl)cyclopenta-2,4-diene-1-carboxamide; iron Traditional Name: 5-bromocyclopenta-1,3-diene; iron; N-(2-methyl-1-methylol-propyl)cyclopenta-2,4-diene-1-carboxamide Formula: C16H20BrFeNO2-2 MolecularWeight: 394.0845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC(=O)[C-]1C=CC=C1.C1=C[C-](C=C1)Br.[Fe]

Isomeric SMILES

CC(C)C(CO)NC(=O)[C-]1C=CC=C1.C1=C[C-](C=C1)Br.[Fe]

InChI

InChI=1S/C11H16NO2.C5H4Br.Fe/c1-8(2)10(7-13)12-11(14)9-5-3-4-6-9;6-5-3-1-2-4-5;/h3-6,8,10,13H,7H2,1-2H3,(H,12,14);1-4H;/q2*-1;