N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[(2R)-3-methyl-2-(4-morpholin-4-iumyl)butyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-ylbutyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H32F3N4O4+ MolecularWeight: 473.50909

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[NH+]3CCOCC3

Isomeric SMILES

CC(C)[C@H](CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[NH+]3CCOCC3

InChI

InChI=1S/C22H31F3N4O4/c1-15(2)20(28-9-11-33-12-10-28)14-26-21(30)16-5-7-27(8-6-16)18-4-3-17(22(23,24)25)13-19(18)29(31)32/h3-4,13,15-16,20H,5-12,14H2,1-2H3,(H,26,30)/p+1/t20-/m0/s1