7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(4-phenylphenoxy)purine-2,6-dione

Systemtic Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(4-phenylphenoxy)purine-2,6-dione Openeye Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(4-phenylphenoxy)purine-2,6-dione CAS Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(4-phenylphenoxy)purine-2,6-dione IUPAC Name: 7-[(3-methoxyphenyl)methyl]-1,3-dimethyl-8-(4-phenylphenoxy)purine-2,6-dione Traditional Name: 7-m-anisyl-1,3-dimethyl-8-(4-phenylphenoxy)xanthine Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)C4=CC=CC=C4)CC5=CC(=CC=C5)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)C4=CC=CC=C4)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C27H24N4O4/c1-29-24-23(25(32)30(2)27(29)33)31(17-18-8-7-11-22(16-18)34-3)26(28-24)35-21-14-12-20(13-15-21)19-9-5-4-6-10-19/h4-16H,17H2,1-3H3