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

Systemtic Name: 1,4-dimethyl-5-nitro-imidazole-2-carbaldehyde Openeye Name: 1,4-dimethyl-5-nitro-imidazole-2-carbaldehyde CAS Name: 1,4-dimethyl-5-nitro-2-imidazolecarboxaldehyde IUPAC Name: 1,4-dimethyl-5-nitroimidazole-2-carbaldehyde Traditional Name: 1,4-dimethyl-5-nitro-imidazole-2-carbaldehyde Formula: C6H7N3O3 MolecularWeight: 169.13808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)C=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N(C(=N1)C=O)C)[N+](=O)[O-]

InChI

InChI=1S/C6H7N3O3/c1-4-6(9(11)12)8(2)5(3-10)7-4/h3H,1-2H3