2-ethyl-2-(hydroxymethyl)propane-1,3-diol trinitrate

Systemtic Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol trinitrate Openeye Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol trinitrate CAS Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol trinitrate IUPAC Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol trinitrate Traditional Name: 2-ethyl-2-methylol-propane-1,3-diol trinitrate Formula: C6H14N3O12-3 MolecularWeight: 320.18826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(CO)CO.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CCC(CO)(CO)CO.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C6H14O3.3NO3/c1-2-6(3-7,4-8)5-9;3*2-1(3)4/h7-9H,2-5H2,1H3;;;/q;3*-1