3-butan-2-yl-1-(5-oxidanylhexyl)-7H-purine-2,6-dione

Systemtic Name: 3-butan-2-yl-1-(5-oxidanylhexyl)-7H-purine-2,6-dione Openeye Name: 1-(5-hydroxyhexyl)-3-sec-butyl-7H-purine-2,6-dione CAS Name: 3-butan-2-yl-1-(5-hydroxyhexyl)-7H-purine-2,6-dione IUPAC Name: 3-butan-2-yl-1-(5-hydroxyhexyl)-7H-purine-2,6-dione Traditional Name: 1-(5-hydroxyhexyl)-3-sec-butyl-7H-purine-2,6-quinone Formula: C15H24N4O3 MolecularWeight: 308.37606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C(=O)N(C1=O)CCCCC(C)O)NC=N2

Isomeric SMILES

CCC(C)N1C2=C(C(=O)N(C1=O)CCCCC(C)O)NC=N2

InChI

InChI=1S/C15H24N4O3/c1-4-10(2)19-13-12(16-9-17-13)14(21)18(15(19)22)8-6-5-7-11(3)20/h9-11,20H,4-8H2,1-3H3,(H,16,17)