2-(2-methyl-4,5-dinitro-imidazol-1-yl)-1-phenyl-ethanone

Systemtic Name: 2-(2-methyl-4,5-dinitro-imidazol-1-yl)-1-phenyl-ethanone Openeye Name: 2-(2-methyl-4,5-dinitro-imidazol-1-yl)-1-phenyl-ethanone CAS Name: 2-(2-methyl-4,5-dinitro-1-imidazolyl)-1-phenylethanone IUPAC Name: 2-(2-methyl-4,5-dinitroimidazol-1-yl)-1-phenylethanone Traditional Name: 2-(2-methyl-4,5-dinitro-imidazol-1-yl)-1-phenyl-ethanone Formula: C12H10N4O5 MolecularWeight: 290.2316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC(=O)C2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(N1CC(=O)C2=CC=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H10N4O5/c1-8-13-11(15(18)19)12(16(20)21)14(8)7-10(17)9-5-3-2-4-6-9/h2-6H,7H2,1H3