8-chloranyl-1-propyl-3-[2,2,2-tris(fluoranyl)ethyl]-7H-purine-2,6-dione

Systemtic Name: 8-chloranyl-1-propyl-3-[2,2,2-tris(fluoranyl)ethyl]-7H-purine-2,6-dione Openeye Name: 8-chloro-1-propyl-3-(2,2,2-trifluoroethyl)-7H-purine-2,6-dione CAS Name: 8-chloro-1-propyl-3-(2,2,2-trifluoroethyl)-7H-purine-2,6-dione IUPAC Name: 8-chloro-1-propyl-3-(2,2,2-trifluoroethyl)-7H-purine-2,6-dione Traditional Name: 8-chloro-1-propyl-3-(2,2,2-trifluoroethyl)-7H-purine-2,6-quinone Formula: C10H10ClF3N4O2 MolecularWeight: 310.66021

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)Cl)N(C1=O)CC(F)(F)F

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)Cl)N(C1=O)CC(F)(F)F

InChI

InChI=1S/C10H10ClF3N4O2/c1-2-3-17-7(19)5-6(16-8(11)15-5)18(9(17)20)4-10(12,13)14/h2-4H2,1H3,(H,15,16)