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

Systemtic Name: 5-(2-bromanyl-5-nitro-phenyl)-1,3-dimethyl-6-pyridin-2-yl-pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-(2-pyridyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-(2-pyridinyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 5-(2-bromo-5-nitrophenyl)-1,3-dimethyl-6-pyridin-2-ylpyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 5-(2-bromo-5-nitro-phenyl)-1,3-dimethyl-6-(2-pyridyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C19H14BrN5O4 MolecularWeight: 456.24956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=C(C=CC(=C3)[N+](=O)[O-])Br)C4=CC=CC=N4

Isomeric SMILES

CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=C(C=CC(=C3)[N+](=O)[O-])Br)C4=CC=CC=N4

InChI

InChI=1S/C19H14BrN5O4/c1-22-14-10-24(15-5-3-4-8-21-15)17(16(14)18(26)23(2)19(22)27)12-9-11(25(28)29)6-7-13(12)20/h3-10H,1-2H3