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

Systemtic Name: methyl 2-imidazol-1-yl-5-nitro-benzoate Openeye Name: methyl 2-imidazol-1-yl-5-nitro-benzoate CAS Name: 2-(1-imidazolyl)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-imidazol-1-yl-5-nitrobenzoate Traditional Name: 2-imidazol-1-yl-5-nitro-benzoic acid methyl ester Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N3O4/c1-18-11(15)9-6-8(14(16)17)2-3-10(9)13-5-4-12-7-13/h2-7H,1H3