4,5,6-trinitrobenzene-1,2,3-triamine

Systemtic Name: 4,5,6-trinitrobenzene-1,2,3-triamine Openeye Name: 4,5,6-trinitrobenzene-1,2,3-triamine CAS Name: 4,5,6-trinitrobenzene-1,2,3-triamine IUPAC Name: 4,5,6-trinitrobenzene-1,2,3-triamine Traditional Name: (2,3-diamino-4,5,6-trinitro-phenyl)amine Formula: C6H6N6O6 MolecularWeight: 258.14844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)N

Isomeric SMILES

C1(=C(C(=C(C(=C1N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)N

InChI

InChI=1S/C6H6N6O6/c7-1-2(8)4(10(13)14)6(12(17)18)5(3(1)9)11(15)16/h7-9H2