6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 6-(2-hydroxyethyl)-1,3-dimethyl-5-(3-nitrophenyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C16H16N4O5 MolecularWeight: 344.32204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=CC=C3)[N+](=O)[O-])CCO

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=CC=C3)[N+](=O)[O-])CCO

InChI

InChI=1S/C16H16N4O5/c1-17-12-9-19(6-7-21)14(13(12)15(22)18(2)16(17)23)10-4-3-5-11(8-10)20(24)25/h3-5,8-9,21H,6-7H2,1-2H3