1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-[4-(trifluoromethyl)phenyl]-7H-purine-2,6-quinone Formula: C14H11F3N4O2 MolecularWeight: 324.25795

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C14H11F3N4O2/c1-20-11-9(12(22)21(2)13(20)23)18-10(19-11)7-3-5-8(6-4-7)14(15,16)17/h3-6H,1-2H3,(H,18,19)