1,3,7-trimethyl-8-(oxan-2-ylmethoxy)purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-(oxan-2-ylmethoxy)purine-2,6-dione Openeye Name: 1,3,7-trimethyl-8-(tetrahydropyran-2-ylmethoxy)purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-(2-oxanylmethoxy)purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-(oxan-2-ylmethoxy)purine-2,6-dione Traditional Name: 1,3,7-trimethyl-8-(tetrahydropyran-2-ylmethoxy)xanthine Formula: C14H20N4O4 MolecularWeight: 308.333

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1OCC3CCCCO3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1OCC3CCCCO3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C14H20N4O4/c1-16-10-11(17(2)14(20)18(3)12(10)19)15-13(16)22-8-9-6-4-5-7-21-9/h9H,4-8H2,1-3H3