3-methyl-8-morpholin-4-yl-7-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)purine-2,6-dione

Systemtic Name: 3-methyl-8-morpholin-4-yl-7-(3-naphthalen-1-yloxy-2-oxidanyl-propyl)purine-2,6-dione Openeye Name: 7-[2-hydroxy-3-(1-naphthyloxy)propyl]-3-methyl-8-morpholino-purine-2,6-dione CAS Name: 7-[2-hydroxy-3-(1-naphthalenyloxy)propyl]-3-methyl-8-(4-morpholinyl)purine-2,6-dione IUPAC Name: 7-(2-hydroxy-3-naphthalen-1-yloxypropyl)-3-methyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 7-[2-hydroxy-3-(1-naphthoxy)propyl]-3-methyl-8-morpholino-xanthine Formula: C23H25N5O5 MolecularWeight: 451.4751

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CC(COC4=CC=CC5=CC=CC=C54)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CC(COC4=CC=CC5=CC=CC=C54)O

InChI

InChI=1S/C23H25N5O5/c1-26-20-19(21(30)25-23(26)31)28(22(24-20)27-9-11-32-12-10-27)13-16(29)14-33-18-8-4-6-15-5-2-3-7-17(15)18/h2-8,16,29H,9-14H2,1H3,(H,25,30,31)