7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-phenoxy-purine-2,6-dione

Systemtic Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-phenoxy-purine-2,6-dione Openeye Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-phenoxy-purine-2,6-dione CAS Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-phenoxypurine-2,6-dione IUPAC Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-phenoxypurine-2,6-dione Traditional Name: 7-m-anisyl-1,3-dimethyl-8-phenoxy-xanthine Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=CC=C3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=CC=C3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C21H20N4O4/c1-23-18-17(19(26)24(2)21(23)27)25(13-14-8-7-11-16(12-14)28-3)20(22-18)29-15-9-5-4-6-10-15/h4-12H,13H2,1-3H3