4-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[oxo-[4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]methyl]-1H-quinolin-2-one IUPAC Name: 4-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]carbostyril Formula: C20H18F3N4O2+ MolecularWeight: 403.37773

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)C(F)(F)F)C(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)C(F)(F)F)C(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C20H17F3N4O2/c21-20(22,23)13-5-6-17(24-12-13)26-7-9-27(10-8-26)19(29)15-11-18(28)25-16-4-2-1-3-14(15)16/h1-6,11-12H,7-10H2,(H,25,28)/p+1