bromanylcyclopentane; iron(2+); methyl 4-(2-bromanylcyclopentyl)-2-methylidene-4-oxidanyl-butanoate

Systemtic Name: bromanylcyclopentane; iron(2+); methyl 4-(2-bromanylcyclopentyl)-2-methylidene-4-oxidanyl-butanoate Openeye Name: ferrous; bromocyclopentane; methyl 4-(2-bromocyclopentyl)-4-hydroxy-2-methylene-butanoate CAS Name: bromocyclopentane; 4-(2-bromocyclopentyl)-4-hydroxy-2-methylenebutanoic acid methyl ester; iron(2+) IUPAC Name: bromocyclopentane; iron(2+); methyl 4-(2-bromocyclopentyl)-4-hydroxy-2-methylidenebutanoate Traditional Name: ferrous; bromocyclopentane; 2-[2-(2-bromocyclopentyl)-2-hydroxy-ethyl]acrylic acid methyl ester Formula: C16H16Br2FeO3+2 MolecularWeight: 471.94944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)CC([C]1[CH][CH][CH][C]1Br)O.[CH]1[CH][CH][C]([CH]1)Br.[Fe+2]

Isomeric SMILES

COC(=O)C(=C)CC([C]1[CH][CH][CH][C]1Br)O.[CH]1[CH][CH][C]([CH]1)Br.[Fe+2]

InChI

InChI=1S/C11H12BrO3.C5H4Br.Fe/c1-7(11(14)15-2)6-10(13)8-4-3-5-9(8)12;6-5-3-1-2-4-5;/h3-5,10,13H,1,6H2,2H3;1-4H;/q;;+2