2-(2,6-dinitrophenyl)-2-oxidanyl-ethanenitrile

Systemtic Name: 2-(2,6-dinitrophenyl)-2-oxidanyl-ethanenitrile Openeye Name: 2-(2,6-dinitrophenyl)-2-hydroxy-acetonitrile CAS Name: 2-(2,6-dinitrophenyl)-2-hydroxyacetonitrile IUPAC Name: 2-(2,6-dinitrophenyl)-2-hydroxyacetonitrile Traditional Name: 2-(2,6-dinitrophenyl)-2-hydroxy-acetonitrile Formula: C8H5N3O5 MolecularWeight: 223.1424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C(C#N)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C(C#N)O)[N+](=O)[O-]

InChI

InChI=1S/C8H5N3O5/c9-4-7(12)8-5(10(13)14)2-1-3-6(8)11(15)16/h1-3,7,12H