1,3-dinitrooxypropan-2-yl nitrate; 2-(2-hydroxyethyloxy)ethanol

Systemtic Name: 1,3-dinitrooxypropan-2-yl nitrate; 2-(2-hydroxyethyloxy)ethanol Openeye Name: 2,3-dinitrooxypropyl nitrate; 2-(2-hydroxyethoxy)ethanol CAS Name: 2-(2-hydroxyethoxy)ethanol; nitric acid 1,3-dinitrooxypropan-2-yl ester IUPAC Name: 1,3-dinitrooxypropan-2-yl nitrate; 2-(2-hydroxyethoxy)ethanol Traditional Name: 2-(2-hydroxyethoxy)ethanol; nitric acid 2,3-dinitrooxypropyl ester Formula: C7H15N3O12 MolecularWeight: 333.2069

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Descriptors Computed from Structure

Canonical SMILES:

C(COCCO)O.C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

C(COCCO)O.C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C4H10O3.C3H5N3O9/c5-1-3-7-4-2-6;7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h5-6H,1-4H2;3H,1-2H2