8-azanyl-7-decyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-azanyl-7-decyl-3-methyl-purine-2,6-dione Openeye Name: 8-amino-7-decyl-3-methyl-purine-2,6-dione CAS Name: 8-amino-7-decyl-3-methylpurine-2,6-dione IUPAC Name: 8-amino-7-decyl-3-methylpurine-2,6-dione Traditional Name: 8-amino-7-decyl-3-methyl-xanthine Formula: C16H27N5O2 MolecularWeight: 321.41788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=C(N=C1N)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCN1C2=C(N=C1N)N(C(=O)NC2=O)C

InChI

InChI=1S/C16H27N5O2/c1-3-4-5-6-7-8-9-10-11-21-12-13(18-15(21)17)20(2)16(23)19-14(12)22/h3-11H2,1-2H3,(H2,17,18)(H,19,22,23)