1-(4-methylphenyl)sulfonyl-N-[[4-(trifluoromethyloxy)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[[4-(trifluoromethyloxy)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(p-tolylsulfonyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[[4-(trifluoromethoxy)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-tosyl-N-[4-(trifluoromethoxy)benzyl]isonipecotamide Formula: C21H23F3N2O4S MolecularWeight: 456.47853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H23F3N2O4S/c1-15-2-8-19(9-3-15)31(28,29)26-12-10-17(11-13-26)20(27)25-14-16-4-6-18(7-5-16)30-21(22,23)24/h2-9,17H,10-14H2,1H3,(H,25,27)