4-azanyl-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitro-phenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-dione

Systemtic Name: 4-azanyl-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitro-phenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-dione Openeye Name: 4-amino-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitro-phenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-dione CAS Name: 4-amino-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitrophenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-dione IUPAC Name: 4-amino-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitrophenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-dione Traditional Name: 4-amino-3-(4-chlorophenyl)-6-(4,5-dimethoxy-2-nitro-phenyl)-5H-pyrimido[5,4-d]pyrimidine-2,8-quinone Formula: C20H15ClN6O6 MolecularWeight: 470.8227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2=NC(=O)C3=NC(=O)N(C(=C3N2)N)C4=CC=C(C=C4)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2=NC(=O)C3=NC(=O)N(C(=C3N2)N)C4=CC=C(C=C4)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C20H15ClN6O6/c1-32-13-7-11(12(27(30)31)8-14(13)33-2)18-23-15-16(19(28)25-18)24-20(29)26(17(15)22)10-5-3-9(21)4-6-10/h3-8H,22H2,1-2H3,(H,23,25,28)