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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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