N1,N3,N5-tritert-butyl-2,4,6-trinitro-benzene-1,3,5-triamine

Systemtic Name: N1,N3,N5-tritert-butyl-2,4,6-trinitro-benzene-1,3,5-triamine Openeye Name: N1,N3,N5-tritert-butyl-2,4,6-trinitro-benzene-1,3,5-triamine CAS Name: N1,N3,N5-tritert-butyl-2,4,6-trinitrobenzene-1,3,5-triamine IUPAC Name: 1-N,3-N,5-N-tritert-butyl-2,4,6-trinitrobenzene-1,3,5-triamine Traditional Name: [3,5-bis(tert-butylamino)-2,4,6-trinitro-phenyl]-tert-butyl-amine Formula: C18H30N6O6 MolecularWeight: 426.4674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=C(C(=C1[N+](=O)[O-])NC(C)(C)C)[N+](=O)[O-])NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC1=C(C(=C(C(=C1[N+](=O)[O-])NC(C)(C)C)[N+](=O)[O-])NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H30N6O6/c1-16(2,3)19-10-13(22(25)26)11(20-17(4,5)6)15(24(29)30)12(14(10)23(27)28)21-18(7,8)9/h19-21H,1-9H3