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

Systemtic Name: 8-(1-adamantyl)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(1-adamantyl)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(1-adamantyl)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(1-adamantyl)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(1-adamantyl)-1,3,7-trimethyl-xanthine Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1C34CC5CC(C3)CC(C5)C4)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1C34CC5CC(C3)CC(C5)C4)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H24N4O2/c1-20-13-14(21(2)17(24)22(3)15(13)23)19-16(20)18-7-10-4-11(8-18)6-12(5-10)9-18/h10-12H,4-9H2,1-3H3