7-decyl-8-(dimethylamino)-3-methyl-purine-2,6-dione

Systemtic Name: 7-decyl-8-(dimethylamino)-3-methyl-purine-2,6-dione Openeye Name: 7-decyl-8-(dimethylamino)-3-methyl-purine-2,6-dione CAS Name: 7-decyl-8-(dimethylamino)-3-methylpurine-2,6-dione IUPAC Name: 7-decyl-8-(dimethylamino)-3-methylpurine-2,6-dione Traditional Name: 7-decyl-8-(dimethylamino)-3-methyl-xanthine Formula: C18H31N5O2 MolecularWeight: 349.47104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31N5O2/c1-5-6-7-8-9-10-11-12-13-23-14-15(19-17(23)21(2)3)22(4)18(25)20-16(14)24/h5-13H2,1-4H3,(H,20,24,25)