8-(2-methoxy-4-phenylmethoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-(2-methoxy-4-phenylmethoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(4-benzyloxy-2-methoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(2-methoxy-4-phenylmethoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(2-methoxy-4-phenylmethoxyphenyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(4-benzoxy-2-methoxy-phenyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=C(C=C3)OCC4=CC=CC=C4)OC

InChI

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