N-(3-chloranyl-2-fluoranyl-phenyl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-fluoro-phenyl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-2-fluorophenyl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-fluorophenyl)-1-[3-(trifluoromethoxy)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-2-fluoro-phenyl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-isonipecotamide Formula: C19H17ClF4N2O4S MolecularWeight: 480.860893

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)F)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C(=CC=C2)Cl)F)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

InChI

InChI=1S/C19H17ClF4N2O4S/c20-15-5-2-6-16(17(15)21)25-18(27)12-7-9-26(10-8-12)31(28,29)14-4-1-3-13(11-14)30-19(22,23)24/h1-6,11-12H,7-10H2,(H,25,27)