8-(6-azanylhexylamino)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-(6-azanylhexylamino)-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-(6-aminohexylamino)-3,7-dimethyl-purine-2,6-dione CAS Name: 8-(6-aminohexylamino)-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-(6-aminohexylamino)-3,7-dimethylpurine-2,6-dione Traditional Name: 8-(6-aminohexylamino)-3,7-dimethyl-xanthine Formula: C13H22N6O2 MolecularWeight: 294.35278

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCCCCCCN)N(C(=O)NC2=O)C

Isomeric SMILES

CN1C2=C(N=C1NCCCCCCN)N(C(=O)NC2=O)C

InChI

InChI=1S/C13H22N6O2/c1-18-9-10(19(2)13(21)17-11(9)20)16-12(18)15-8-6-4-3-5-7-14/h3-8,14H2,1-2H3,(H,15,16)(H,17,20,21)