2-(dimethylamino)-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]-3H-purin-6-one

Systemtic Name: 2-(dimethylamino)-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)pyrrolidin-2-yl]-3H-purin-6-one Openeye Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-2-(dimethylamino)-3H-purin-6-one CAS Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)-2-pyrrolidinyl]-2-(dimethylamino)-3H-purin-6-one IUPAC Name: 9-[3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-2-(dimethylamino)-3H-purin-6-one Traditional Name: 9-(3,4-dihydroxy-5-methylol-pyrrolidin-2-yl)-2-(dimethylamino)-3H-purin-6-one Formula: C12H18N6O4 MolecularWeight: 310.30912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(N3)CO)O)O

Isomeric SMILES

CN(C)C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(N3)CO)O)O

InChI

InChI=1S/C12H18N6O4/c1-17(2)12-15-9-6(11(22)16-12)13-4-18(9)10-8(21)7(20)5(3-19)14-10/h4-5,7-8,10,14,19-21H,3H2,1-2H3,(H,15,16,22)