8-(4-ethoxy-3-methoxy-phenyl)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-(4-ethoxy-3-methoxy-phenyl)-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-(4-ethoxy-3-methoxy-phenyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 8-(4-ethoxy-3-methoxyphenyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-(4-ethoxy-3-methoxyphenyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 8-(4-ethoxy-3-methoxy-phenyl)-3,7-dimethyl-xanthine Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC3=C(N2C)C(=O)NC(=O)N3C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC3=C(N2C)C(=O)NC(=O)N3C)OC

InChI

InChI=1S/C16H18N4O4/c1-5-24-10-7-6-9(8-11(10)23-4)13-17-14-12(19(13)2)15(21)18-16(22)20(14)3/h6-8H,5H2,1-4H3,(H,18,21,22)