1,3-dimethyl-7-(10-oxidanyldecyl)purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(10-oxidanyldecyl)purine-2,6-dione Openeye Name: 7-(10-hydroxydecyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(10-hydroxydecyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(10-hydroxydecyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(10-hydroxydecyl)-1,3-dimethyl-xanthine Formula: C17H28N4O3 MolecularWeight: 336.42922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCCCCCCCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCCCCCCCO

InChI

InChI=1S/C17H28N4O3/c1-19-15-14(16(23)20(2)17(19)24)21(13-18-15)11-9-7-5-3-4-6-8-10-12-22/h13,22H,3-12H2,1-2H3