8-(3-methoxyphenoxy)-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-(3-methoxyphenoxy)-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-(3-methoxyphenoxy)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(3-methoxyphenoxy)-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-(3-methoxyphenoxy)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-benzyl-8-(3-methoxyphenoxy)-1,3-dimethyl-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)OC)CC4=CC=CC=C4

Isomeric SMILES

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

InChI

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