N-[4-bromanyl-3-(trifluoromethyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-1-mesyl-pipecolinamide Formula: C14H16BrF3N2O3S MolecularWeight: 429.25265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C14H16BrF3N2O3S/c1-24(22,23)20-7-3-2-4-12(20)13(21)19-9-5-6-11(15)10(8-9)14(16,17)18/h5-6,8,12H,2-4,7H2,1H3,(H,19,21)