2-tert-butyl-5-chloranyl-1-(2,2-dimethylpropyl)-4-nitro-imidazole

Systemtic Name: 2-tert-butyl-5-chloranyl-1-(2,2-dimethylpropyl)-4-nitro-imidazole Openeye Name: 2-tert-butyl-5-chloro-1-(2,2-dimethylpropyl)-4-nitro-imidazole CAS Name: 2-tert-butyl-5-chloro-1-(2,2-dimethylpropyl)-4-nitroimidazole IUPAC Name: 2-tert-butyl-5-chloro-1-(2,2-dimethylpropyl)-4-nitroimidazole Traditional Name: 2-tert-butyl-5-chloro-1-neopentyl-4-nitro-imidazole Formula: C12H20ClN3O2 MolecularWeight: 273.7591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C(=C(N=C1C(C)(C)C)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)CN1C(=C(N=C1C(C)(C)C)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H20ClN3O2/c1-11(2,3)7-15-8(13)9(16(17)18)14-10(15)12(4,5)6/h7H2,1-6H3