2,4,6-tris(trinitromethyl)-1,3,5-triazine

Systemtic Name: 2,4,6-tris(trinitromethyl)-1,3,5-triazine Openeye Name: 2,4,6-tris(trinitromethyl)-1,3,5-triazine CAS Name: 2,4,6-tris(trinitromethyl)-1,3,5-triazine IUPAC Name: 2,4,6-tris(trinitromethyl)-1,3,5-triazine Traditional Name: 2,4,6-tris(trinitromethyl)-s-triazine Formula: C6N12O18 MolecularWeight: 528.1338

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Descriptors Computed from Structure

Canonical SMILES:

C1(=NC(=NC(=N1)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1(=NC(=NC(=N1)C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6N12O18/c19-10(20)4(11(21)22,12(23)24)1-7-2(5(13(25)26,14(27)28)15(29)30)9-3(8-1)6(16(31)32,17(33)34)18(35)36