8-(dimethylamino)-3-methyl-7-[(2R)-2-oxidanyl-2-phenyl-ethyl]purine-2,6-dione

Systemtic Name: 8-(dimethylamino)-3-methyl-7-[(2R)-2-oxidanyl-2-phenyl-ethyl]purine-2,6-dione Openeye Name: 8-(dimethylamino)-7-[(2R)-2-hydroxy-2-phenyl-ethyl]-3-methyl-purine-2,6-dione CAS Name: 8-(dimethylamino)-7-[(2R)-2-hydroxy-2-phenylethyl]-3-methylpurine-2,6-dione IUPAC Name: 8-(dimethylamino)-7-[(2R)-2-hydroxy-2-phenylethyl]-3-methylpurine-2,6-dione Traditional Name: 8-(dimethylamino)-7-[(2R)-2-hydroxy-2-phenyl-ethyl]-3-methyl-xanthine Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)C)CC(C3=CC=CC=C3)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)C)C[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C16H19N5O3/c1-19(2)15-17-13-12(14(23)18-16(24)20(13)3)21(15)9-11(22)10-7-5-4-6-8-10/h4-8,11,22H,9H2,1-3H3,(H,18,23,24)/t11-/m0/s1