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

Systemtic Name: 8-(diphenylmethyl)oxy-7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-benzhydryloxy-7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-(diphenylmethyl)oxy-7-[(3-methoxyphenyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-benzhydryloxy-7-[(3-methoxyphenyl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-benzhydryloxy-7-m-anisyl-1,3-dimethyl-xanthine Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC(=CC=C5)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C28H26N4O4/c1-30-25-23(26(33)31(2)28(30)34)32(18-19-11-10-16-22(17-19)35-3)27(29-25)36-24(20-12-6-4-7-13-20)21-14-8-5-9-15-21/h4-17,24H,18H2,1-3H3