O6-[(1S)-1-(6-bromanylpyridin-2-yl)ethyl] O2-[(1R)-1-pyridin-2-ylethyl] pyridine-2,6-dicarboxylate

Systemtic Name: O6-[(1S)-1-(6-bromanylpyridin-2-yl)ethyl] O2-[(1R)-1-pyridin-2-ylethyl] pyridine-2,6-dicarboxylate Openeye Name: O6-[(1S)-1-(6-bromo-2-pyridyl)ethyl] O2-[(1R)-1-(2-pyridyl)ethyl] pyridine-2,6-dicarboxylate CAS Name: pyridine-2,6-dicarboxylic acid O6-[(1S)-1-(6-bromo-2-pyridinyl)ethyl] ester O2-[(1R)-1-(2-pyridinyl)ethyl] ester IUPAC Name: 6-O-[(1S)-1-(6-bromopyridin-2-yl)ethyl] 2-O-[(1R)-1-pyridin-2-ylethyl] pyridine-2,6-dicarboxylate Traditional Name: pyridine-2,6-dicarboxylic acid O6-[(1S)-1-(6-bromo-2-pyridyl)ethyl] ester O2-[(1R)-1-(2-pyridyl)ethyl] ester Formula: C21H18BrN3O4 MolecularWeight: 456.28932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=CC=C1)Br)OC(=O)C2=CC=CC(=N2)C(=O)OC(C)C3=CC=CC=N3

Isomeric SMILES

C[C@@H](C1=NC(=CC=C1)Br)OC(=O)C2=CC=CC(=N2)C(=O)O[C@H](C)C3=CC=CC=N3

InChI

InChI=1S/C21H18BrN3O4/c1-13(15-7-3-4-12-23-15)28-20(26)17-9-5-10-18(24-17)21(27)29-14(2)16-8-6-11-19(22)25-16/h3-14H,1-2H3/t13-,14+/m1/s1