1H-imidazol-5-yl 3-aminocarbonyl-5-nitro-benzoate

Systemtic Name: 1H-imidazol-5-yl 3-aminocarbonyl-5-nitro-benzoate Openeye Name: 1H-imidazol-5-yl 3-carbamoyl-5-nitro-benzoate CAS Name: 3-carbamoyl-5-nitrobenzoic acid 1H-imidazol-5-yl ester IUPAC Name: 1H-imidazol-5-yl 3-carbamoyl-5-nitrobenzoate Traditional Name: 3-carbamoyl-5-nitro-benzoic acid 1H-imidazol-5-yl ester Formula: C11H8N4O5 MolecularWeight: 276.20502

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)OC2=CN=CN2)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=C(C=C(C=C1C(=O)OC2=CN=CN2)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C11H8N4O5/c12-10(16)6-1-7(3-8(2-6)15(18)19)11(17)20-9-4-13-5-14-9/h1-5H,(H2,12,16)(H,13,14)