8-azanyl-3-methyl-7-(2-oxidanyl-3-propan-2-yloxy-propyl)purine-2,6-dione

Systemtic Name: 8-azanyl-3-methyl-7-(2-oxidanyl-3-propan-2-yloxy-propyl)purine-2,6-dione Openeye Name: 8-amino-7-(2-hydroxy-3-isopropoxy-propyl)-3-methyl-purine-2,6-dione CAS Name: 8-amino-7-(2-hydroxy-3-propan-2-yloxypropyl)-3-methylpurine-2,6-dione IUPAC Name: 8-amino-7-(2-hydroxy-3-propan-2-yloxypropyl)-3-methylpurine-2,6-dione Traditional Name: 8-amino-7-(2-hydroxy-3-isopropoxy-propyl)-3-methyl-xanthine Formula: C12H19N5O4 MolecularWeight: 297.31036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N5O4/c1-6(2)21-5-7(18)4-17-8-9(14-11(17)13)16(3)12(20)15-10(8)19/h6-7,18H,4-5H2,1-3H3,(H2,13,14)(H,15,19,20)