8-methyl-1-(2-oxidanylpropyl)-3-propyl-7H-purine-2,6-dione

Systemtic Name: 8-methyl-1-(2-oxidanylpropyl)-3-propyl-7H-purine-2,6-dione Openeye Name: 1-(2-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione CAS Name: 1-(2-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione IUPAC Name: 1-(2-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-dione Traditional Name: 1-(2-hydroxypropyl)-8-methyl-3-propyl-7H-purine-2,6-quinone Formula: C12H18N4O3 MolecularWeight: 266.29632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CC(C)O)NC(=N2)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CC(C)O)NC(=N2)C

InChI

InChI=1S/C12H18N4O3/c1-4-5-15-10-9(13-8(3)14-10)11(18)16(12(15)19)6-7(2)17/h7,17H,4-6H2,1-3H3,(H,13,14)