1,3-dimethyl-7-[[(2R)-oxiran-2-yl]methyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[[(2R)-oxiran-2-yl]methyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[[(2R)-oxiran-2-yl]methyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[[(2R)-2-oxiranyl]methyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[[(2R)-oxiran-2-yl]methyl]purine-2,6-dione Traditional Name: 1,3-dimethyl-7-[[(2R)-oxiran-2-yl]methyl]xanthine Formula: C10H12N4O3 MolecularWeight: 236.22728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3CO3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)C[C@@H]3CO3

InChI

InChI=1S/C10H12N4O3/c1-12-8-7(9(15)13(2)10(12)16)14(5-11-8)3-6-4-17-6/h5-6H,3-4H2,1-2H3/t6-/m1/s1