N-phenyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide

Systemtic Name: N-phenyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Openeye Name: N-phenyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide CAS Name: N-phenyl-4-[2-(trifluoromethyl)-4-quinolin-1-iumyl]-1-piperazinecarboxamide IUPAC Name: N-phenyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Traditional Name: N-phenyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Formula: C21H20F3N4O+ MolecularWeight: 401.40491

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H19F3N4O/c22-21(23,24)19-14-18(16-8-4-5-9-17(16)26-19)27-10-12-28(13-11-27)20(29)25-15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,25,29)/p+1