(phenylmethyl) (2S)-5-bromanyl-2-(2,2-dimethylpropanoyloxymethyl)-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-5-bromanyl-2-(2,2-dimethylpropanoyloxymethyl)-2H-pyridine-1-carboxylate Openeye Name: benzyl (2S)-5-bromo-2-(2,2-dimethylpropanoyloxymethyl)-2H-pyridine-1-carboxylate CAS Name: (2S)-5-bromo-2-[(2,2-dimethyl-1-oxopropoxy)methyl]-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-5-bromo-2-(2,2-dimethylpropanoyloxymethyl)-2H-pyridine-1-carboxylate Traditional Name: (2S)-5-bromo-2-(pivaloyloxymethyl)-2H-pyridine-1-carboxylic acid benzyl ester Formula: C19H22BrNO4 MolecularWeight: 408.28628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1C=CC(=CN1C(=O)OCC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)(C)C(=O)OC[C@@H]1C=CC(=CN1C(=O)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C19H22BrNO4/c1-19(2,3)17(22)24-13-16-10-9-15(20)11-21(16)18(23)25-12-14-7-5-4-6-8-14/h4-11,16H,12-13H2,1-3H3/t16-/m0/s1