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

Systemtic Name: N-heptan-2-yl-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-methylhexyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-heptan-2-yl-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-heptan-2-yl-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-methylhexyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C20H29F3N2O3S MolecularWeight: 434.51607

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29F3N2O3S/c1-3-4-5-8-15(2)24-19(26)16-11-13-25(14-12-16)29(27,28)18-10-7-6-9-17(18)20(21,22)23/h6-7,9-10,15-16H,3-5,8,11-14H2,1-2H3,(H,24,26)