4-[(1-methyl-5-nitro-benzimidazol-2-yl)methylamino]benzenecarbonitrile

Systemtic Name: 4-[(1-methyl-5-nitro-benzimidazol-2-yl)methylamino]benzenecarbonitrile Openeye Name: 4-[(1-methyl-5-nitro-benzimidazol-2-yl)methylamino]benzonitrile CAS Name: 4-[(1-methyl-5-nitro-2-benzimidazolyl)methylamino]benzonitrile IUPAC Name: 4-[(1-methyl-5-nitrobenzimidazol-2-yl)methylamino]benzonitrile Traditional Name: 4-[(1-methyl-5-nitro-benzimidazol-2-yl)methylamino]benzonitrile Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CNC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CNC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N5O2/c1-20-15-7-6-13(21(22)23)8-14(15)19-16(20)10-18-12-4-2-11(9-17)3-5-12/h2-8,18H,10H2,1H3