N-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-fluoranyl-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C20H20F4N2O4S MolecularWeight: 460.442413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C20H20F4N2O4S/c1-30-15-3-5-16(6-4-15)31(28,29)26-10-8-13(9-11-26)19(27)25-14-2-7-18(21)17(12-14)20(22,23)24/h2-7,12-13H,8-11H2,1H3,(H,25,27)