4-ethynyl-1,2-dimethyl-5-nitro-imidazole

Systemtic Name: 4-ethynyl-1,2-dimethyl-5-nitro-imidazole Openeye Name: 4-ethynyl-1,2-dimethyl-5-nitro-imidazole CAS Name: 4-ethynyl-1,2-dimethyl-5-nitroimidazole IUPAC Name: 4-ethynyl-1,2-dimethyl-5-nitroimidazole Traditional Name: 4-ethynyl-1,2-dimethyl-5-nitro-imidazole Formula: C7H7N3O2 MolecularWeight: 165.14938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1C)[N+](=O)[O-])C#C

Isomeric SMILES

CC1=NC(=C(N1C)[N+](=O)[O-])C#C

InChI

InChI=1S/C7H7N3O2/c1-4-6-7(10(11)12)9(3)5(2)8-6/h1H,2-3H3