1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(trifluoromethyl)-7H-purine-2,6-quinone Formula: C8H7F3N4O2 MolecularWeight: 248.16199

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C(F)(F)F

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C(F)(F)F

InChI

InChI=1S/C8H7F3N4O2/c1-14-4-3(5(16)15(2)7(14)17)12-6(13-4)8(9,10)11/h1-2H3,(H,12,13)