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

Systemtic Name: N-(2,4-dimethoxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,4-dimethoxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,4-dimethoxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,4-dimethoxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,4-dimethoxyphenyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C21H23F3N2O5S MolecularWeight: 472.47793

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N2O5S/c1-30-15-7-8-17(18(13-15)31-2)25-20(27)14-9-11-26(12-10-14)32(28,29)19-6-4-3-5-16(19)21(22,23)24/h3-8,13-14H,9-12H2,1-2H3,(H,25,27)