[5-(4,5-diaminocarbonylimidazol-1-yl)-3,4-dinitrooxy-oxolan-2-yl]methyl nitrate

Systemtic Name: [5-(4,5-diaminocarbonylimidazol-1-yl)-3,4-dinitrooxy-oxolan-2-yl]methyl nitrate Openeye Name: [5-(4,5-dicarbamoylimidazol-1-yl)-3,4-dinitrooxy-tetrahydrofuran-2-yl]methyl nitrate CAS Name: nitric acid [5-(4,5-dicarbamoyl-1-imidazolyl)-3,4-dinitrooxy-2-oxolanyl]methyl ester IUPAC Name: [5-(4,5-dicarbamoylimidazol-1-yl)-3,4-dinitrooxyoxolan-2-yl]methyl nitrate Traditional Name: nitric acid [5-(4,5-dicarbamoylimidazol-1-yl)-3,4-dinitrooxy-tetrahydrofuran-2-yl]methyl ester Formula: C10H11N7O12 MolecularWeight: 421.23404

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C(N1C2C(C(C(O2)CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])C(=O)N)C(=O)N

Isomeric SMILES

C1=NC(=C(N1C2C(C(C(O2)CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-])C(=O)N)C(=O)N

InChI

InChI=1S/C10H11N7O12/c11-8(18)4-5(9(12)19)14(2-13-4)10-7(29-17(24)25)6(28-16(22)23)3(27-10)1-26-15(20)21/h2-3,6-7,10H,1H2,(H2,11,18)(H2,12,19)