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

Systemtic Name: N-butyl-1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-butyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-butyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-butyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-butyl-1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C17H22ClF3N2O3S MolecularWeight: 426.88139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H22ClF3N2O3S/c1-2-3-8-22-16(24)12-6-9-23(10-7-12)27(25,26)13-4-5-15(18)14(11-13)17(19,20)21/h4-5,11-12H,2-3,6-10H2,1H3,(H,22,24)