9-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 9-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 9-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-1,3-dimethyl-xanthine Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CN2C=NC3=C2N(C(=O)N(C3=O)C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CN2C=NC3=C2N(C(=O)N(C3=O)C)C)OC

InChI

InChI=1S/C19H25N5O4/c1-6-28-14-8-7-13(9-15(14)27-5)10-21(2)12-24-11-20-16-17(24)22(3)19(26)23(4)18(16)25/h7-9,11H,6,10,12H2,1-5H3