3-methyl-7-(2-oxidanyl-3-phenoxy-propyl)-8-pyrrolidin-1-yl-purine-2,6-dione

Systemtic Name: 3-methyl-7-(2-oxidanyl-3-phenoxy-propyl)-8-pyrrolidin-1-yl-purine-2,6-dione Openeye Name: 7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-8-pyrrolidin-1-yl-purine-2,6-dione CAS Name: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-(1-pyrrolidinyl)purine-2,6-dione IUPAC Name: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-pyrrolidin-1-ylpurine-2,6-dione Traditional Name: 7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-8-pyrrolidino-xanthine Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCC3)CC(COC4=CC=CC=C4)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCC3)CC(COC4=CC=CC=C4)O

InChI

InChI=1S/C19H23N5O4/c1-22-16-15(17(26)21-19(22)27)24(18(20-16)23-9-5-6-10-23)11-13(25)12-28-14-7-3-2-4-8-14/h2-4,7-8,13,25H,5-6,9-12H2,1H3,(H,21,26,27)