3,7-dimethyl-1-(11-morpholin-4-yl-10-oxidanyl-undecyl)purine-2,6-dione

Systemtic Name: 3,7-dimethyl-1-(11-morpholin-4-yl-10-oxidanyl-undecyl)purine-2,6-dione Openeye Name: 1-(10-hydroxy-11-morpholino-undecyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[10-hydroxy-11-(4-morpholinyl)undecyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-(10-hydroxy-11-morpholin-4-ylundecyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 1-(10-hydroxy-11-morpholino-undecyl)-3,7-dimethyl-xanthine Formula: C22H37N5O4 MolecularWeight: 435.56028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC(CN3CCOCC3)O

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC(CN3CCOCC3)O

InChI

InChI=1S/C22H37N5O4/c1-24-17-23-20-19(24)21(29)27(22(30)25(20)2)11-9-7-5-3-4-6-8-10-18(28)16-26-12-14-31-15-13-26/h17-18,28H,3-16H2,1-2H3