N-pentan-3-yl-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-pentan-3-yl-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-ethylpropyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-pentan-3-yl-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-pentan-3-yl-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-ethylpropyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C18H25F3N2O3S MolecularWeight: 406.46291

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCC(CC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C18H25F3N2O3S/c1-3-14(4-2)22-17(24)13-9-11-23(12-10-13)27(25,26)16-8-6-5-7-15(16)18(19,20)21/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,22,24)