8-[(3,4-dimethoxyphenyl)amino]-7-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-[(3,4-dimethoxyphenyl)amino]-7-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-(3,4-dimethoxyanilino)-7-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(3,4-dimethoxyanilino)-7-(2-hydroxyethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-(3,4-dimethoxyanilino)-7-(2-hydroxyethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-(3,4-dimethoxyanilino)-7-(2-hydroxyethyl)-1,3-dimethyl-xanthine Formula: C17H21N5O5 MolecularWeight: 375.37914

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NC3=CC(=C(C=C3)OC)OC)CCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NC3=CC(=C(C=C3)OC)OC)CCO

InChI

InChI=1S/C17H21N5O5/c1-20-14-13(15(24)21(2)17(20)25)22(7-8-23)16(19-14)18-10-5-6-11(26-3)12(9-10)27-4/h5-6,9,23H,7-8H2,1-4H3,(H,18,19)