2-(2,3-dimethyl-4-nitro-2H-imidazol-1-yl)-1-phenyl-ethanone chloride

Systemtic Name: 2-(2,3-dimethyl-4-nitro-2H-imidazol-1-yl)-1-phenyl-ethanone chloride Openeye Name: 2-(2,3-dimethyl-4-nitro-2H-imidazol-1-yl)-1-phenyl-ethanone chloride CAS Name: 2-(2,3-dimethyl-4-nitro-2H-imidazol-1-yl)-1-phenylethanone chloride IUPAC Name: 2-(2,3-dimethyl-4-nitro-2H-imidazol-1-yl)-1-phenylethanone chloride Traditional Name: 2-(2,3-dimethyl-4-nitro-4-imidazolin-1-yl)-1-phenyl-ethanone chloride Formula: C13H15ClN3O3- MolecularWeight: 296.7295

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Descriptors Computed from Structure

Canonical SMILES:

CC1N(C(=CN1CC(=O)C2=CC=CC=C2)[N+](=O)[O-])C.[Cl-]

Isomeric SMILES

CC1N(C(=CN1CC(=O)C2=CC=CC=C2)[N+](=O)[O-])C.[Cl-]

InChI

InChI=1S/C13H15N3O3.ClH/c1-10-14(2)13(16(18)19)9-15(10)8-12(17)11-6-4-3-5-7-11;/h3-7,9-10H,8H2,1-2H3;1H/p-1