ethyl 2-imidazol-1-yl-5-nitro-benzoate

Systemtic Name: ethyl 2-imidazol-1-yl-5-nitro-benzoate Openeye Name: ethyl 2-imidazol-1-yl-5-nitro-benzoate CAS Name: 2-(1-imidazolyl)-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-imidazol-1-yl-5-nitrobenzoate Traditional Name: 2-imidazol-1-yl-5-nitro-benzoic acid ethyl ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2C=CN=C2

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2C=CN=C2

InChI

InChI=1S/C12H11N3O4/c1-2-19-12(16)10-7-9(15(17)18)3-4-11(10)14-6-5-13-8-14/h3-8H,2H2,1H3