diethyl 4-[5-bromanyl-2-(trifluoromethylsulfonyloxy)phenyl]-1-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-[5-bromanyl-2-(trifluoromethylsulfonyloxy)phenyl]-1-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 4-[5-bromo-2-(trifluoromethylsulfonyloxy)phenyl]-1-(p-tolyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 4-[5-bromo-2-(trifluoromethylsulfonyloxy)phenyl]-1-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-[5-bromo-2-(trifluoromethylsulfonyloxy)phenyl]-1-(4-methylphenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(5-bromo-2-triflyloxy-phenyl)-1-(p-tolyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C25H23BrF3NO7S MolecularWeight: 618.41683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OS(=O)(=O)C(F)(F)F)C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CN(C=C(C1C2=C(C=CC(=C2)Br)OS(=O)(=O)C(F)(F)F)C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H23BrF3NO7S/c1-4-35-23(31)19-13-30(17-9-6-15(3)7-10-17)14-20(24(32)36-5-2)22(19)18-12-16(26)8-11-21(18)37-38(33,34)25(27,28)29/h6-14,22H,4-5H2,1-3H3