5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6H-pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C14H11BrN4O4 MolecularWeight: 379.16554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CNC(=C2C(=O)N(C1=O)C)C3=C(C=CC(=C3)[N+](=O)[O-])Br

Isomeric SMILES

CN1C2=CNC(=C2C(=O)N(C1=O)C)C3=C(C=CC(=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C14H11BrN4O4/c1-17-10-6-16-12(11(10)13(20)18(2)14(17)21)8-5-7(19(22)23)3-4-9(8)15/h3-6,16H,1-2H3