7-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl]-1,3-dimethyl-xanthine Formula: C16H18N8O4 MolecularWeight: 386.36532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C16H18N8O4/c1-19-11-9(13(25)21(3)15(19)27)23(7-17-11)5-6-24-8-18-12-10(24)14(26)22(4)16(28)20(12)2/h7-8H,5-6H2,1-4H3