butane-1,1,1-triol trinitrate

Systemtic Name: butane-1,1,1-triol trinitrate Openeye Name: butane-1,1,1-triol trinitrate CAS Name: butane-1,1,1-triol trinitrate IUPAC Name: butane-1,1,1-triol trinitrate Traditional Name: butane-1,1,1-triol trinitrate Formula: C4H10N3O12-3 MolecularWeight: 292.1351

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)(O)O.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CCCC(O)(O)O.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C4H10O3.3NO3/c1-2-3-4(5,6)7;3*2-1(3)4/h5-7H,2-3H2,1H3;;;/q;3*-1