5-nitro-N4-[(E)-(2-nitrophenyl)methylideneamino]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-[(E)-(2-nitrophenyl)methylideneamino]pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-[(E)-(2-nitrophenyl)methyleneamino]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[(E)-(2-nitrophenyl)methylideneamino]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-[(E)-(2-nitrophenyl)methylideneamino]pyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[(E)-(2-nitrobenzylidene)amino]amine Formula: C11H9N7O4 MolecularWeight: 303.23366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC2=NC=NC(=C2[N+](=O)[O-])N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC2=NC=NC(=C2[N+](=O)[O-])N)[N+](=O)[O-]

InChI

InChI=1S/C11H9N7O4/c12-10-9(18(21)22)11(14-6-13-10)16-15-5-7-3-1-2-4-8(7)17(19)20/h1-6H,(H3,12,13,14,16)/b15-5+