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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCO

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCCO

InChI

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