N-(2,6-dimethylphenyl)-2-(4-nitroimidazol-1-yl)ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-(4-nitroimidazol-1-yl)ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-(4-nitroimidazol-1-yl)acetamide CAS Name: N-(2,6-dimethylphenyl)-2-(4-nitro-1-imidazolyl)acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-(4-nitroimidazol-1-yl)acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-(4-nitroimidazol-1-yl)acetamide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3/c1-9-4-3-5-10(2)13(9)15-12(18)7-16-6-11(14-8-16)17(19)20/h3-6,8H,7H2,1-2H3,(H,15,18)