3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate

Systemtic Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate Openeye Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate CAS Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate IUPAC Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate Traditional Name: 3,6-dinitrocyclohexane-1,2,4,5-tetrol dihydrate Formula: C6H14N2O10 MolecularWeight: 274.18276

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(C(C(C(C1O)O)[N+](=O)[O-])O)O)[N+](=O)[O-].O.O

Isomeric SMILES

C1(C(C(C(C(C1O)O)[N+](=O)[O-])O)O)[N+](=O)[O-].O.O

InChI

InChI=1S/C6H10N2O8.2H2O/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16;;/h1-6,9-12H;2*1H2