5-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]-1H-pyrimidine-2,4-dione

Systemtic Name: 5-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]-1H-pyrimidine-2,4-dione Openeye Name: 5-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]-1H-pyrimidine-2,4-dione CAS Name: 5-[4-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]-1H-pyrimidine-2,4-dione IUPAC Name: 5-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]-1H-pyrimidine-2,4-dione Traditional Name: 5-[4-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]uracil Formula: C14H14ClF3N5O2+ MolecularWeight: 376.74147

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CNC(=O)NC2=O)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CNC(=O)NC2=O)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C14H13ClF3N5O2/c15-9-5-8(14(16,17)18)6-19-11(9)23-3-1-22(2-4-23)10-7-20-13(25)21-12(10)24/h5-7H,1-4H2,(H2,20,21,24,25)/p+1