2-(2-chloranyl-4-nitro-imidazol-1-yl)ethanenitrile

Systemtic Name: 2-(2-chloranyl-4-nitro-imidazol-1-yl)ethanenitrile Openeye Name: 2-(2-chloro-4-nitro-imidazol-1-yl)acetonitrile CAS Name: 2-(2-chloro-4-nitro-1-imidazolyl)acetonitrile IUPAC Name: 2-(2-chloro-4-nitroimidazol-1-yl)acetonitrile Traditional Name: 2-(2-chloro-4-nitro-imidazol-1-yl)acetonitrile Formula: C5H3ClN4O2 MolecularWeight: 186.55592

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(N1CC#N)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=C(N=C(N1CC#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C5H3ClN4O2/c6-5-8-4(10(11)12)3-9(5)2-1-7/h3H,2H2