6-(chloromethyl)-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-6-oxidanyl-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(chloromethyl)-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-6-oxidanyl-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(chloromethyl)-6-hydroxy-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(chloromethyl)-6-hydroxy-1-methyl-3-(1-methyl-5-nitro-2-imidazolyl)-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(chloromethyl)-6-hydroxy-1-methyl-3-(1-methyl-5-nitroimidazol-2-yl)-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(chloromethyl)-6-hydroxy-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C11H12ClN7O4 MolecularWeight: 341.71048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C2=C3C(=O)NC(N=C3N(N2)C)(CCl)O)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C2=C3C(=O)NC(N=C3N(N2)C)(CCl)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12ClN7O4/c1-17-5(19(22)23)3-13-9(17)7-6-8(18(2)16-7)14-11(21,4-12)15-10(6)20/h3,16,21H,4H2,1-2H3,(H,15,20)