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

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

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C14H16BrF3N2O3S/c1-24(22,23)20-6-4-9(5-7-20)13(21)19-10-2-3-12(15)11(8-10)14(16,17)18/h2-3,8-9H,4-7H2,1H3,(H,19,21)