N-phenyl-1-propyl-N-[2-[[4-(trifluoromethyl)phenyl]carbonylamino]ethyl]pyridin-1-ium-2-carboxamide

Systemtic Name: N-phenyl-1-propyl-N-[2-[[4-(trifluoromethyl)phenyl]carbonylamino]ethyl]pyridin-1-ium-2-carboxamide Openeye Name: N-phenyl-1-propyl-N-[2-[[4-(trifluoromethyl)benzoyl]amino]ethyl]pyridin-1-ium-2-carboxamide CAS Name: N-[2-[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]-N-phenyl-1-propyl-2-pyridin-1-iumcarboxamide IUPAC Name: N-phenyl-1-propyl-N-[2-[[4-(trifluoromethyl)benzoyl]amino]ethyl]pyridin-1-ium-2-carboxamide Traditional Name: N-phenyl-1-propyl-N-[2-[[4-(trifluoromethyl)benzoyl]amino]ethyl]pyridin-1-ium-2-carboxamide Formula: C25H25F3N3O2+ MolecularWeight: 456.48011

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC=CC=C1C(=O)N(CCNC(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCC[N+]1=CC=CC=C1C(=O)N(CCNC(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C25H24F3N3O2/c1-2-16-30-17-7-6-10-22(30)24(33)31(21-8-4-3-5-9-21)18-15-29-23(32)19-11-13-20(14-12-19)25(26,27)28/h3-14,17H,2,15-16,18H2,1H3/p+1