3,3,3-trinitropropane-1,1,1-triol

Systemtic Name: 3,3,3-trinitropropane-1,1,1-triol Openeye Name: 3,3,3-trinitropropane-1,1,1-triol CAS Name: 3,3,3-trinitropropane-1,1,1-triol IUPAC Name: 3,3,3-trinitropropane-1,1,1-triol Traditional Name: 3,3,3-trinitropropane-1,1,1-triol Formula: C3H5N3O9 MolecularWeight: 227.0865

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H5N3O9/c7-3(8,9)1-2(4(10)11,5(12)13)6(14)15/h7-9H,1H2