N-[(3,5-dimethoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,5-dimethoxybenzyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C22H25F3N2O5S MolecularWeight: 486.50451

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)OC

InChI

InChI=1S/C22H25F3N2O5S/c1-31-17-11-15(12-18(13-17)32-2)14-26-21(28)16-7-9-27(10-8-16)33(29,30)20-6-4-3-5-19(20)22(23,24)25/h3-6,11-13,16H,7-10,14H2,1-2H3,(H,26,28)