1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(2-ethanoylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(2-ethanoylphenyl)piperidine-4-carboxamide Openeye Name: N-(2-acetylphenyl)-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-acetylphenyl)-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-acetylphenyl)-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-acetylphenyl)-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C21H20ClF3N2O4S MolecularWeight: 488.90771

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H20ClF3N2O4S/c1-13(28)16-4-2-3-5-19(16)26-20(29)14-8-10-27(11-9-14)32(30,31)15-6-7-18(22)17(12-15)21(23,24)25/h2-7,12,14H,8-11H2,1H3,(H,26,29)