7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-[bis(2-hydroxyethyl)amino]ethyl]-1,3-dimethyl-xanthine Formula: C13H21N5O4 MolecularWeight: 311.33694

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN(CCO)CCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN(CCO)CCO

InChI

InChI=1S/C13H21N5O4/c1-15-11-10(12(21)16(2)13(15)22)18(9-14-11)4-3-17(5-7-19)6-8-20/h9,19-20H,3-8H2,1-2H3