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

Systemtic Name: N-butyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Openeye Name: N-butyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide CAS Name: N-butyl-4-[2-(trifluoromethyl)-4-quinolin-1-iumyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[2-(trifluoromethyl)quinolin-1-ium-4-yl]piperazine-1-carboxamide Formula: C19H24F3N4O+ MolecularWeight: 381.41527

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1)C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1)C2=CC(=[NH+]C3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C19H23F3N4O/c1-2-3-8-23-18(27)26-11-9-25(10-12-26)16-13-17(19(20,21)22)24-15-7-5-4-6-14(15)16/h4-7,13H,2-3,8-12H2,1H3,(H,23,27)/p+1