4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]carbostyril Formula: C20H17ClF3N4O2+ MolecularWeight: 437.82279

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)C(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)C(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C20H16ClF3N4O2/c21-15-9-12(20(22,23)24)11-25-18(15)27-5-7-28(8-6-27)19(30)14-10-17(29)26-16-4-2-1-3-13(14)16/h1-4,9-11H,5-8H2,(H,26,29)/p+1