N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-methyl-N-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-methyl-N-(2-morpholino-2-oxo-ethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-methyl-N-[2-(4-morpholinyl)-2-oxoethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(2-keto-2-morpholino-ethyl)-N-methyl-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C20H25F3N4O5 MolecularWeight: 458.43151

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCOCC1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)N1CCOCC1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H25F3N4O5/c1-24(13-18(28)26-8-10-32-11-9-26)19(29)14-4-6-25(7-5-14)16-3-2-15(20(21,22)23)12-17(16)27(30)31/h2-3,12,14H,4-11,13H2,1H3