8-[methoxy(phenyl)methyl]-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-[methoxy(phenyl)methyl]-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-[methoxy(phenyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[methoxy(phenyl)methyl]-1,3-dimethyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-[methoxy(phenyl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-benzyl-8-[methoxy(phenyl)methyl]-1,3-dimethyl-xanthine Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O3/c1-24-19-17(21(27)25(2)22(24)28)26(14-15-10-6-4-7-11-15)20(23-19)18(29-3)16-12-8-5-9-13-16/h4-13,18H,14H2,1-3H3