[6-(dioxidanylmethyl)-2,4-dimethyl-pyridin-3-yl] 3-bromanylpropanoate

Systemtic Name: [6-(dioxidanylmethyl)-2,4-dimethyl-pyridin-3-yl] 3-bromanylpropanoate Openeye Name: [6-(hydroperoxymethyl)-2,4-dimethyl-3-pyridyl] 3-bromopropanoate CAS Name: 3-bromopropanoic acid [6-(hydroperoxymethyl)-2,4-dimethyl-3-pyridinyl] ester IUPAC Name: [6-(hydroperoxymethyl)-2,4-dimethylpyridin-3-yl] 3-bromopropanoate Traditional Name: 3-bromopropionic acid [6-(hydroperoxymethyl)-2,4-dimethyl-3-pyridyl] ester Formula: C11H14BrNO4 MolecularWeight: 304.13716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1OC(=O)CCBr)C)COO

Isomeric SMILES

CC1=CC(=NC(=C1OC(=O)CCBr)C)COO

InChI

InChI=1S/C11H14BrNO4/c1-7-5-9(6-16-15)13-8(2)11(7)17-10(14)3-4-12/h5,15H,3-4,6H2,1-2H3