3-(4,5-dimethylimidazol-1-yl)-5-nitro-benzenecarbonitrile

Systemtic Name: 3-(4,5-dimethylimidazol-1-yl)-5-nitro-benzenecarbonitrile Openeye Name: 3-(4,5-dimethylimidazol-1-yl)-5-nitro-benzonitrile CAS Name: 3-(4,5-dimethyl-1-imidazolyl)-5-nitrobenzonitrile IUPAC Name: 3-(4,5-dimethylimidazol-1-yl)-5-nitrobenzonitrile Traditional Name: 3-(4,5-dimethylimidazol-1-yl)-5-nitro-benzonitrile Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=N1)C2=CC(=CC(=C2)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(N(C=N1)C2=CC(=CC(=C2)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C12H10N4O2/c1-8-9(2)15(7-14-8)11-3-10(6-13)4-12(5-11)16(17)18/h3-5,7H,1-2H3