7-ethyl-1,3-dipropyl-8-[2,2,2-tris(fluoranyl)ethoxy]purine-2,6-dione

Systemtic Name: 7-ethyl-1,3-dipropyl-8-[2,2,2-tris(fluoranyl)ethoxy]purine-2,6-dione Openeye Name: 7-ethyl-1,3-dipropyl-8-(2,2,2-trifluoroethoxy)purine-2,6-dione CAS Name: 7-ethyl-1,3-dipropyl-8-(2,2,2-trifluoroethoxy)purine-2,6-dione IUPAC Name: 7-ethyl-1,3-dipropyl-8-(2,2,2-trifluoroethoxy)purine-2,6-dione Traditional Name: 7-ethyl-1,3-dipropyl-8-(2,2,2-trifluoroethoxy)xanthine Formula: C15H21F3N4O3 MolecularWeight: 362.34745

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)OCC(F)(F)F)CC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)OCC(F)(F)F)CC

InChI

InChI=1S/C15H21F3N4O3/c1-4-7-21-11-10(12(23)22(8-5-2)14(21)24)20(6-3)13(19-11)25-9-15(16,17)18/h4-9H2,1-3H3