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9-undecyl-3H-purine-2,6-dione

9-undecyl-3H-purine-2,6-dione

Systemtic Name:9-undecyl-3H-purine-2,6-dione
Openeye Name:9-undecyl-3H-purine-2,6-dione
CAS Name:9-undecyl-3H-purine-2,6-dione
IUPAC Name:9-undecyl-3H-purine-2,6-dione
Traditional Name:9-undecylxanthine
Formula: C16H26N4O2
MolecularWeight: 306.40324
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C=NC2=C1NC(=O)NC2=O


Isomeric SMILES

CCCCCCCCCCCN1C=NC2=C1NC(=O)NC2=O


InChI

InChI=1S/C16H26N4O2/c1-2-3-4-5-6-7-8-9-10-11-20-12-17-13-14(20)18-16(22)19-15(13)21/h12H,2-11H2,1H3,(H2,18,19,21,22)


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