N-(2-morpholin-4-ium-4-ylethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C19H26F3N4O4+ MolecularWeight: 431.42935

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC[NH+]2CCOCC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC[NH+]2CCOCC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H25F3N4O4/c20-19(21,22)15-1-2-16(17(13-15)26(28)29)25-6-3-14(4-7-25)18(27)23-5-8-24-9-11-30-12-10-24/h1-2,13-14H,3-12H2,(H,23,27)/p+1