sodium [2,2-bis(nitrooxymethyl)-3-oxidanidyloxysulfonothioyl-propyl] nitrate

Systemtic Name: sodium [2,2-bis(nitrooxymethyl)-3-oxidanidyloxysulfonothioyl-propyl] nitrate Openeye Name: sodium [2,2-bis(nitrooxymethyl)-3-oxidooxysulfonothioyl-propyl] nitrate CAS Name: sodium nitric acid [2,2-bis(nitrooxymethyl)-3-oxidooxysulfonothioylpropyl] ester IUPAC Name: sodium [2,2-bis(nitrooxymethyl)-3-oxidooxysulfonothioylpropyl] nitrate Traditional Name: sodium nitric acid [2,2-bis(nitrooxymethyl)-3-oxidooxysulfonothioyl-propyl] ester Formula: C5H8N3NaO12S2 MolecularWeight: 389.24969

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CS(=O)(=S)O[O-])O[N+](=O)[O-].[Na+]

Isomeric SMILES

C(C(CO[N+](=O)[O-])(CO[N+](=O)[O-])CS(=O)(=S)O[O-])O[N+](=O)[O-].[Na+]

InChI

InChI=1S/C5H9N3O12S2.Na/c9-6(10)17-1-5(2-18-7(11)12,3-19-8(13)14)4-22(16,21)20-15;/h15H,1-4H2;/q;+1/p-1