2-(5,6-dimethylbenzimidazol-1-yl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(5,6-dimethylbenzimidazol-1-yl)-5-nitro-benzenecarbonitrile Openeye Name: 2-(5,6-dimethylbenzimidazol-1-yl)-5-nitro-benzonitrile CAS Name: 2-(5,6-dimethyl-1-benzimidazolyl)-5-nitrobenzonitrile IUPAC Name: 2-(5,6-dimethylbenzimidazol-1-yl)-5-nitrobenzonitrile Traditional Name: 2-(5,6-dimethylbenzimidazol-1-yl)-5-nitro-benzonitrile Formula: C16H12N4O2 MolecularWeight: 292.29208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H12N4O2/c1-10-5-14-16(6-11(10)2)19(9-18-14)15-4-3-13(20(21)22)7-12(15)8-17/h3-7,9H,1-2H3