1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-4H-imidazol-4-yl]ethanone

Systemtic Name: 1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-4H-imidazol-4-yl]ethanone Openeye Name: 1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-4H-imidazol-4-yl]ethanone CAS Name: 1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-4H-imidazol-4-yl]ethanone IUPAC Name: 1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-4H-imidazol-4-yl]ethanone Traditional Name: 1-[5,5-dimethyl-3-(2-nitrophenyl)sulfonyl-2-(trichloromethyl)-2-imidazolin-4-yl]ethanone Formula: C14H14Cl3N3O5S MolecularWeight: 442.70206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(N=C(N1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(Cl)(Cl)Cl)(C)C

Isomeric SMILES

CC(=O)C1C(N=C(N1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(Cl)(Cl)Cl)(C)C

InChI

InChI=1S/C14H14Cl3N3O5S/c1-8(21)11-13(2,3)18-12(14(15,16)17)19(11)26(24,25)10-7-5-4-6-9(10)20(22)23/h4-7,11H,1-3H3