1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-octyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-octyl-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(morpholinomethyl)-7-octyl-purine-2,6-dione CAS Name: 1,3-dimethyl-8-(4-morpholinylmethyl)-7-octylpurine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-octylpurine-2,6-dione Traditional Name: 1,3-dimethyl-8-(morpholinomethyl)-7-octyl-xanthine Formula: C20H33N5O3 MolecularWeight: 391.50772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCOCC3

Isomeric SMILES

CCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCOCC3

InChI

InChI=1S/C20H33N5O3/c1-4-5-6-7-8-9-10-25-16(15-24-11-13-28-14-12-24)21-18-17(25)19(26)23(3)20(27)22(18)2/h4-15H2,1-3H3