2-isocyanato-1,1,1-trinitro-ethane

Systemtic Name: 2-isocyanato-1,1,1-trinitro-ethane Openeye Name: 2-isocyanato-1,1,1-trinitro-ethane CAS Name: 2-isocyanato-1,1,1-trinitroethane IUPAC Name: 2-isocyanato-1,1,1-trinitroethane Traditional Name: 2-isocyanato-1,1,1-trinitro-ethane Formula: C3H2N4O7 MolecularWeight: 206.07058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H2N4O7/c8-2-4-1-3(5(9)10,6(11)12)7(13)14/h1H2