2-(2-methyl-4-nitro-imidazol-1-yl)-1-(4-methylphenyl)ethanone

Systemtic Name: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(4-methylphenyl)ethanone Openeye Name: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(p-tolyl)ethanone CAS Name: 2-(2-methyl-4-nitro-1-imidazolyl)-1-(4-methylphenyl)ethanone IUPAC Name: 2-(2-methyl-4-nitroimidazol-1-yl)-1-(4-methylphenyl)ethanone Traditional Name: 2-(2-methyl-4-nitro-imidazol-1-yl)-1-(p-tolyl)ethanone Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C=C(N=C2C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C=C(N=C2C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3/c1-9-3-5-11(6-4-9)12(17)7-15-8-13(16(18)19)14-10(15)2/h3-6,8H,7H2,1-2H3