2,4-dinitrosobenzene-1,3-diol hydrate

Systemtic Name: 2,4-dinitrosobenzene-1,3-diol hydrate Openeye Name: 2,4-dinitrosobenzene-1,3-diol hydrate CAS Name: 2,4-dinitrosobenzene-1,3-diol hydrate IUPAC Name: 2,4-dinitrosobenzene-1,3-diol hydrate Traditional Name: 2,4-dinitrosoresorcinol hydrate Formula: C6H6N2O5 MolecularWeight: 186.12224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1N=O)O)N=O)O.O

Isomeric SMILES

C1=CC(=C(C(=C1N=O)O)N=O)O.O

InChI

InChI=1S/C6H4N2O4.H2O/c9-4-2-1-3(7-11)6(10)5(4)8-12;/h1-2,9-10H;1H2