4-fluoranyl-3-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzonitrile CAS Name: 4-fluoro-3-[[methyl-(3-methyl-5-nitro-4-imidazolyl)amino]methyl]benzonitrile IUPAC Name: 4-fluoro-3-[[methyl-(3-methyl-5-nitroimidazol-4-yl)amino]methyl]benzonitrile Traditional Name: 4-fluoro-3-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzonitrile Formula: C13H12FN5O2 MolecularWeight: 289.265083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N(C)CC2=C(C=CC(=C2)C#N)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N(C)CC2=C(C=CC(=C2)C#N)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12FN5O2/c1-17(13-12(19(20)21)16-8-18(13)2)7-10-5-9(6-15)3-4-11(10)14/h3-5,8H,7H2,1-2H3