5-nitro-N4,N6-bis(3-nitrophenyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N6-bis(3-nitrophenyl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4,N6-bis(3-nitrophenyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N6-bis(3-nitrophenyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N,6-N-bis(3-nitrophenyl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]-(3-nitrophenyl)amine Formula: C16H11N7O6 MolecularWeight: 397.30184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC2=C(C(=NC=N2)NC3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H11N7O6/c24-21(25)12-5-1-3-10(7-12)19-15-14(23(28)29)16(18-9-17-15)20-11-4-2-6-13(8-11)22(26)27/h1-9H,(H2,17,18,19,20)