7-decan-2-yl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-decan-2-yl-1,3-dimethyl-purine-2,6-dione Openeye Name: 1,3-dimethyl-7-(1-methylnonyl)purine-2,6-dione CAS Name: 7-decan-2-yl-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-decan-2-yl-1,3-dimethylpurine-2,6-dione Traditional Name: 1,3-dimethyl-7-(1-methylnonyl)xanthine Formula: C17H28N4O2 MolecularWeight: 320.42982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C)N1C=NC2=C1C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCCCCCC(C)N1C=NC2=C1C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H28N4O2/c1-5-6-7-8-9-10-11-13(2)21-12-18-15-14(21)16(22)20(4)17(23)19(15)3/h12-13H,5-11H2,1-4H3