8-azanyl-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione

Systemtic Name: 8-azanyl-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione Openeye Name: 8-amino-3-methyl-7-(2-methylallyl)purine-2,6-dione CAS Name: 8-amino-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione IUPAC Name: 8-amino-3-methyl-7-(2-methylprop-2-enyl)purine-2,6-dione Traditional Name: 8-amino-3-methyl-7-(2-methylallyl)xanthine Formula: C10H13N5O2 MolecularWeight: 235.24252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=C(N=C1N)N(C(=O)NC2=O)C

Isomeric SMILES

CC(=C)CN1C2=C(N=C1N)N(C(=O)NC2=O)C

InChI

InChI=1S/C10H13N5O2/c1-5(2)4-15-6-7(12-9(15)11)14(3)10(17)13-8(6)16/h1,4H2,2-3H3,(H2,11,12)(H,13,16,17)