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1,1,3-tris(2,2,2-trinitroethyl)urea

1,1,3-tris(2,2,2-trinitroethyl)urea

Systemtic Name:1,1,3-tris(2,2,2-trinitroethyl)urea
Openeye Name:1,1,3-tris(2,2,2-trinitroethyl)urea
CAS Name:1,1,3-tris(2,2,2-trinitroethyl)urea
IUPAC Name:1,1,3-tris(2,2,2-trinitroethyl)urea
Traditional Name:1,1,3-tris(2,2,2-trinitroethyl)urea
Formula: C7H7N11O19
MolecularWeight: 549.19278
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H7N11O19/c19-4(8-1-5(10(20)21,11(22)23)12(24)25)9(2-6(13(26)27,14(28)29)15(30)31)3-7(16(32)33,17(34)35)18(36)37/h1-3H2,(H,8,19)


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