2-(3-nitro-4-oxidanyl-phenoxy)ethanenitrile

Systemtic Name: 2-(3-nitro-4-oxidanyl-phenoxy)ethanenitrile Openeye Name: 2-(4-hydroxy-3-nitro-phenoxy)acetonitrile CAS Name: 2-(4-hydroxy-3-nitrophenoxy)acetonitrile IUPAC Name: 2-(4-hydroxy-3-nitrophenoxy)acetonitrile Traditional Name: 2-(4-hydroxy-3-nitro-phenoxy)acetonitrile Formula: C8H6N2O4 MolecularWeight: 194.14424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCC#N)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1OCC#N)[N+](=O)[O-])O

InChI

InChI=1S/C8H6N2O4/c9-3-4-14-6-1-2-8(11)7(5-6)10(12)13/h1-2,5,11H,4H2