methyl 6-[bis(fluoranyl)methyl]-2-(tert-butylsulfamoyl)pyridine-3-carboxylate

Systemtic Name: methyl 6-[bis(fluoranyl)methyl]-2-(tert-butylsulfamoyl)pyridine-3-carboxylate Openeye Name: methyl 2-(tert-butylsulfamoyl)-6-(difluoromethyl)pyridine-3-carboxylate CAS Name: 2-(tert-butylsulfamoyl)-6-(difluoromethyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-(tert-butylsulfamoyl)-6-(difluoromethyl)pyridine-3-carboxylate Traditional Name: 2-(tert-butylsulfamoyl)-6-(difluoromethyl)nicotinic acid methyl ester Formula: C12H16F2N2O4S MolecularWeight: 322.328246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=N1)C(F)F)C(=O)OC

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(C=CC(=N1)C(F)F)C(=O)OC

InChI

InChI=1S/C12H16F2N2O4S/c1-12(2,3)16-21(18,19)10-7(11(17)20-4)5-6-8(15-10)9(13)14/h5-6,9,16H,1-4H3