6-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-methyl-1H-pyrimidine-2,4-dione; tris(fluoranyl)methanesulfonate

Systemtic Name: 6-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-methyl-1H-pyrimidine-2,4-dione; tris(fluoranyl)methanesulfonate Openeye Name: 6-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-methyl-1H-pyrimidine-2,4-dione; trifluoromethanesulfonate CAS Name: 6-[4-(dimethylamino)-1-pyridin-1-iumyl]-3-methyl-1H-pyrimidine-2,4-dione; trifluoromethanesulfonate IUPAC Name: 6-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-methyl-1H-pyrimidine-2,4-dione; trifluoromethanesulfonate Traditional Name: 6-[4-(dimethylamino)pyridin-1-ium-1-yl]-3-methyl-uracil triflate Formula: C13H15F3N4O5S MolecularWeight: 396.34221

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(NC1=O)[N+]2=CC=C(C=C2)N(C)C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CN1C(=O)C=C(NC1=O)[N+]2=CC=C(C=C2)N(C)C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H14N4O2.CHF3O3S/c1-14(2)9-4-6-16(7-5-9)10-8-11(17)15(3)12(18)13-10;2-1(3,4)8(5,6)7/h4-8H,1-3H3;(H,5,6,7)