7-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione

Systemtic Name: 7-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione Openeye Name: 7-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione CAS Name: 7-[[4-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]-oxomethyl]-4-ethyl-1H-quinoxaline-2,3-dione IUPAC Name: 7-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione Traditional Name: 7-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-quinone Formula: C21H20ClF3N5O3+ MolecularWeight: 482.86341

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=C(C=C(C=[NH+]4)C(F)(F)F)Cl)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=C(C=C(C=[NH+]4)C(F)(F)F)Cl)NC(=O)C1=O

InChI

InChI=1S/C21H19ClF3N5O3/c1-2-30-16-4-3-12(9-15(16)27-18(31)20(30)33)19(32)29-7-5-28(6-8-29)17-14(22)10-13(11-26-17)21(23,24)25/h3-4,9-11H,2,5-8H2,1H3,(H,27,31)/p+1