4-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoate

Systemtic Name: 4-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]benzoate Openeye Name: 4-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate CAS Name: 4-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]benzoate IUPAC Name: 4-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate Traditional Name: 4-[(4-nitro-1H-pyrrole-2-carbonyl)amino]benzoate Formula: C12H8N3O5- MolecularWeight: 274.20902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC(=O)C2=CC(=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC(=O)C2=CC(=CN2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O5/c16-11(10-5-9(6-13-10)15(19)20)14-8-3-1-7(2-4-8)12(17)18/h1-6,13H,(H,14,16)(H,17,18)/p-1