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N-[2-(2-methyl-1-piperidinyl)-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide
SpectraBase Compound ID I0ShgFiyDWK
InChI InChI=1S/C26H28F6N4O3/c1-16-4-2-3-11-35(16)21-7-5-18(25(27,28)29)14-20(21)33-24(37)17-9-12-34(13-10-17)22-8-6-19(26(30,31)32)15-23(22)36(38)39/h5-8,14-17H,2-4,9-13H2,1H3,(H,33,37)
InChIKey XKNBPADBCYBFAX-UHFFFAOYSA-N
Mol Weight 558.53 g/mol
Molecular Formula C26H28F6N4O3
Exact Mass 558.20656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EYjPYPzLHa7
Name N-[2-(2-methyl-1-piperidinyl)-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide
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Formula C26H28F6N4O3
InChI InChI=1S/C26H28F6N4O3/c1-16-4-2-3-11-35(16)21-7-5-18(25(27,28)29)14-20(21)33-24(37)17-9-12-34(13-10-17)22-8-6-19(26(30,31)32)15-23(22)36(38)39/h5-8,14-17H,2-4,9-13H2,1H3,(H,33,37)
InChIKey XKNBPADBCYBFAX-UHFFFAOYSA-N
Molecular Weight 558.525 g/mol
SMILES N(c1c(N2C(C)CCCC2)ccc(C(F)(F)F)c1)C(C1CCN(c2c(N(=O)=O)cc(C(F)(F)F)cc2)CC1)=O
SPLASH splash10-000i-1491000000-84f5b42d9c46c572582b
Synonyms N-[2-(2-methyl-1-piperidyl)-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide N-[2-(2-methylpiperidin-1-yl)-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide N-[2-(2-methylpiperidino)-5-(trifluoromethyl)phenyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide
Wiley ID 1437080