(3-chloranyloxy-1,1,1,5,5,5-hexanitro-pentan-3-yl) hypochlorite

Systemtic Name: (3-chloranyloxy-1,1,1,5,5,5-hexanitro-pentan-3-yl) hypochlorite Openeye Name: [1-chlorooxy-3,3,3-trinitro-1-(2,2,2-trinitroethyl)propyl] hypochlorite CAS Name: hypochlorous acid (3-chlorooxy-1,1,1,5,5,5-hexanitropentan-3-yl) ester IUPAC Name: (3-chlorooxy-1,1,1,5,5,5-hexanitropentan-3-yl) hypochlorite Traditional Name: hypochlorous acid [1-chlorooxy-3,3,3-trinitro-1-(2,2,2-trinitroethyl)propyl] ester Formula: C5H4Cl2N6O14 MolecularWeight: 443.02306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H4Cl2N6O14/c6-26-3(27-7,1-4(8(14)15,9(16)17)10(18)19)2-5(11(20)21,12(22)23)13(24)25/h1-2H2