8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-7-(2-oxidanylpropyl)purine-2,6-dione

Systemtic Name: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-7-(2-oxidanylpropyl)purine-2,6-dione Openeye Name: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-(2-hydroxypropyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[4-(2-hydroxyethyl)-1-piperazinyl]-7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[4-(2-hydroxyethyl)piperazino]-7-(2-hydroxypropyl)-1,3-dimethyl-xanthine Formula: C16H26N6O4 MolecularWeight: 366.41544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(N=C1N3CCN(CC3)CCO)N(C(=O)N(C2=O)C)C)O

Isomeric SMILES

CC(CN1C2=C(N=C1N3CCN(CC3)CCO)N(C(=O)N(C2=O)C)C)O

InChI

InChI=1S/C16H26N6O4/c1-11(24)10-22-12-13(18(2)16(26)19(3)14(12)25)17-15(22)21-6-4-20(5-7-21)8-9-23/h11,23-24H,4-10H2,1-3H3