[2-[4-[2-(methylsulfonylamino)ethyl]phenyl]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-[4-[2-(methylsulfonylamino)ethyl]phenyl]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-keto-2-[4-[2-(methanesulfonamido)ethyl]phenyl]ethyl] ester Formula: C17H17BrN2O5S MolecularWeight: 441.29628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C17H17BrN2O5S/c1-26(23,24)20-7-6-12-2-4-13(5-3-12)16(21)11-25-17(22)14-8-15(18)10-19-9-14/h2-5,8-10,20H,6-7,11H2,1H3