2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanenitrile

Systemtic Name: 2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)ethanenitrile Openeye Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetonitrile CAS Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetonitrile IUPAC Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetonitrile Traditional Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)acetonitrile Formula: C4H2BrN5O2 MolecularWeight: 231.99498

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)N1C(=NC(=N1)[N+](=O)[O-])Br

Isomeric SMILES

C(C#N)N1C(=NC(=N1)[N+](=O)[O-])Br

InChI

InChI=1S/C4H2BrN5O2/c5-3-7-4(10(11)12)8-9(3)2-1-6/h2H2