N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-[4-fluoro-2-(trifluoromethyl)benzyl]-1-mesyl-nipecotamide Formula: C15H18F4N2O3S MolecularWeight: 382.373633

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N1CCCC(C1)C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F

InChI

InChI=1S/C15H18F4N2O3S/c1-25(23,24)21-6-2-3-11(9-21)14(22)20-8-10-4-5-12(16)7-13(10)15(17,18)19/h4-5,7,11H,2-3,6,8-9H2,1H3,(H,20,22)