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

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[4-fluoranyl-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]isonipecotamide Formula: C21H22F4N2O5S MolecularWeight: 490.468393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22F4N2O5S/c1-31-18-6-4-15(12-19(18)32-2)33(29,30)27-9-7-13(8-10-27)20(28)26-14-3-5-17(22)16(11-14)21(23,24)25/h3-6,11-13H,7-10H2,1-2H3,(H,26,28)